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Phenylpropanoic acids

Organic compounds consisting of a carboxylic acid with the formula: C9H10O2; also known as hydrocinnamic acid. They are widely used in cosmetics, as food additives, and in the pharmaceutical industry.

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1

(S)-(+)-2-Phenylpropionic acid, 97%

CAS: 7782-24-3 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00063139 InChI Key: YPGCWEMNNLXISK-ZETCQYMHSA-N Synonym: s-+-2-phenylpropionic acid,s-2-phenylpropanoic acid,2s-2-phenylpropanoic acid,s-hydratropic acid,+-hydratropic acid,s-2-phenyl-propionic acid,s-alpha-methylbenzeneacetic acid,s-2-phenylpropionic acid,s-+-hydratropic acid,unii-988109nfbc PubChem CID: 2724622 ChEBI: CHEBI:48527 IUPAC Name: (2S)-2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O

PubChem CID 2724622
CAS 7782-24-3
Molecular Weight (g/mol) 150.177
ChEBI CHEBI:48527
MDL Number MFCD00063139
SMILES CC(C1=CC=CC=C1)C(=O)O
Synonym s-+-2-phenylpropionic acid,s-2-phenylpropanoic acid,2s-2-phenylpropanoic acid,s-hydratropic acid,+-hydratropic acid,s-2-phenyl-propionic acid,s-alpha-methylbenzeneacetic acid,s-2-phenylpropionic acid,s-+-hydratropic acid,unii-988109nfbc
IUPAC Name (2S)-2-phenylpropanoic acid
InChI Key YPGCWEMNNLXISK-ZETCQYMHSA-N
Molecular Formula C9H10O2
2
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(S)-(+)-Ibuprofen, 99%, Thermo Scientific Chemicals

CAS: 51146-56-6 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.28 MDL Number: MFCD00069289 InChI Key: HEFNNWSXXWATRW-JTQLQIEISA-N Synonym: s-+-ibuprofen,dexibuprofen,s +-ibuprofen,s-2-4-isobutylphenyl propanoic acid,s-ibuprofen,d-ibuproten,s-+-2-4-isobutylphenyl propionic acid,s-+-4-isobutyl-alpha-methylphenylacetic acid,+-s-p-isobutylhydratropic acid,seractil PubChem CID: 39912 ChEBI: CHEBI:43415 IUPAC Name: (2S)-2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(=O)O

PubChem CID 39912
CAS 51146-56-6
Molecular Weight (g/mol) 206.28
ChEBI CHEBI:43415
MDL Number MFCD00069289
SMILES CC(C)CC1=CC=C(C=C1)C(C)C(=O)O
Synonym s-+-ibuprofen,dexibuprofen,s +-ibuprofen,s-2-4-isobutylphenyl propanoic acid,s-ibuprofen,d-ibuproten,s-+-2-4-isobutylphenyl propionic acid,s-+-4-isobutyl-alpha-methylphenylacetic acid,+-s-p-isobutylhydratropic acid,seractil
IUPAC Name (2S)-2-[4-(2-methylpropyl)phenyl]propanoic acid
InChI Key HEFNNWSXXWATRW-JTQLQIEISA-N
Molecular Formula C13H18O2
3

(S)-(-)-3-Hydroxy-3-phenylpropionic acid, 98+%

CAS: 36567-72-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00145262 InChI Key: AYOLELPCNDVZKZ-QMMMGPOBSA-N Synonym: s-3-hydroxy-3-phenylpropanoic acid,3s-3-hydroxy-3-phenylpropanoic acid,s-3-hydroxy-3-phenylpropionic acid,?-3-phenylhydracrylic acid,s---3-hydroxy-3-phenylpropionic acid,benzenepropanoic acid,,a-hydroxy-,,as,s---3-hydroxy-3-phenylpropionic acid, 98+%,unii-s2w4lws09c component,s-3-hydroxy-3-phenylpropionic acid sum of enantiomers, gc PubChem CID: 2735057 ChEBI: CHEBI:51058 IUPAC Name: (3S)-3-hydroxy-3-phenylpropanoic acid SMILES: C1=CC=C(C=C1)C(CC(=O)O)O

PubChem CID 2735057
CAS 36567-72-3
Molecular Weight (g/mol) 166.176
ChEBI CHEBI:51058
MDL Number MFCD00145262
SMILES C1=CC=C(C=C1)C(CC(=O)O)O
Synonym s-3-hydroxy-3-phenylpropanoic acid,3s-3-hydroxy-3-phenylpropanoic acid,s-3-hydroxy-3-phenylpropionic acid,?-3-phenylhydracrylic acid,s---3-hydroxy-3-phenylpropionic acid,benzenepropanoic acid,,a-hydroxy-,,as,s---3-hydroxy-3-phenylpropionic acid, 98+%,unii-s2w4lws09c component,s-3-hydroxy-3-phenylpropionic acid sum of enantiomers, gc
IUPAC Name (3S)-3-hydroxy-3-phenylpropanoic acid
InChI Key AYOLELPCNDVZKZ-QMMMGPOBSA-N
Molecular Formula C9H10O3
4

(S)-3-(Boc-amino)-3-phenylpropionic acid, 95%

CAS: 103365-47-5 Molecular Formula: C14H19NO4 Molecular Weight (g/mol): 265.309 MDL Number: MFCD01860892 InChI Key: JTNQFJPZRTURSI-NSHDSACASA-N Synonym: boc-s-3-amino-3-phenylpropionic acid,s-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,s-3-n-boc-amino-beta-phenylalanine,s-n-boc-3-amino-3-phenylpropanoic acid,boc-d-beta-phe-oh,boc-d-beta-phenylalanine,s-boc-beta3-phenylalanine,boc-s-phenylalanine,3s-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,s-3-boc-amino-3-phenylpropionic acid PubChem CID: 2734490 IUPAC Name: (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1

PubChem CID 2734490
CAS 103365-47-5
Molecular Weight (g/mol) 265.309
MDL Number MFCD01860892
SMILES CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC=CC=C1
Synonym boc-s-3-amino-3-phenylpropionic acid,s-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,s-3-n-boc-amino-beta-phenylalanine,s-n-boc-3-amino-3-phenylpropanoic acid,boc-d-beta-phe-oh,boc-d-beta-phenylalanine,s-boc-beta3-phenylalanine,boc-s-phenylalanine,3s-3-tert-butoxycarbonyl amino-3-phenylpropanoic acid,s-3-boc-amino-3-phenylpropionic acid
IUPAC Name (3S)-3-[(2-methylpropan-2-yl)oxycarbonylamino]-3-phenylpropanoic acid
InChI Key JTNQFJPZRTURSI-NSHDSACASA-N
Molecular Formula C14H19NO4
5

(S)-3-Hydroxy-3-phenylpropanoic acid, 99%

CAS: 36567-72-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.18 MDL Number: MFCD00145262 InChI Key: AYOLELPCNDVZKZ-QMMMGPOBSA-N Synonym: s-3-hydroxy-3-phenylpropanoic acid,3s-3-hydroxy-3-phenylpropanoic acid,s-3-hydroxy-3-phenylpropionic acid,?-3-phenylhydracrylic acid,s---3-hydroxy-3-phenylpropionic acid,benzenepropanoic acid,,a-hydroxy-,,as,s---3-hydroxy-3-phenylpropionic acid, 98+%,unii-s2w4lws09c component,s-3-hydroxy-3-phenylpropionic acid sum of enantiomers, gc PubChem CID: 2735057 ChEBI: CHEBI:51058 IUPAC Name: (3S)-3-hydroxy-3-phenylpropanoic acid SMILES: C1=CC=C(C=C1)C(CC(=O)O)O

PubChem CID 2735057
CAS 36567-72-3
Molecular Weight (g/mol) 166.18
ChEBI CHEBI:51058
MDL Number MFCD00145262
SMILES C1=CC=C(C=C1)C(CC(=O)O)O
Synonym s-3-hydroxy-3-phenylpropanoic acid,3s-3-hydroxy-3-phenylpropanoic acid,s-3-hydroxy-3-phenylpropionic acid,?-3-phenylhydracrylic acid,s---3-hydroxy-3-phenylpropionic acid,benzenepropanoic acid,,a-hydroxy-,,as,s---3-hydroxy-3-phenylpropionic acid, 98+%,unii-s2w4lws09c component,s-3-hydroxy-3-phenylpropionic acid sum of enantiomers, gc
IUPAC Name (3S)-3-hydroxy-3-phenylpropanoic acid
InChI Key AYOLELPCNDVZKZ-QMMMGPOBSA-N
Molecular Formula C9H10O3
6

(S)-(-)-Carbidopa, TRC

CAS: 28860-95-9 Molecular Formula: C10 H14 N2 O4 Molecular Weight (g/mol): 226.23 Synonym: (αS)-α-Hydrazinyl-3,4-dihydroxy-α-methylbenzenepropanoic acid (ACI),Benzenepropanoic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, (S)- (ZCI),Benzenepropanoic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, (αS)- (9CI),Hydrocinnamic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, L- (8CI),(-)-L-α-Hydrazino-3,4-dihydroxy-α-methylhydrocinamic acid,(-)-L-α-Hydrazino-3,4-dihydroxy-α-methylhydrocinnamic acid monohydrate,(2S)-2-(Aminoazaniumyl)-3-(3,4-dihydroxyphenyl)-2-methylpropanoate,(2S)-3-(3,4-Dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid,(S)-Carbidopa,1-α-(3,4-Dihydroxybenzyl)-α-hydrazinopropionic acid,L-3-(3,4-Dihydroxyphenyl)-2-methyl-2-hydrazinopropionic acid,L-Carbidopa,L-α-(3,4-Dihydroxybenzyl)-α-hydrazinopropionic acid,L-α-Hydrazino-3,4-dihydroxy-α-methylbenzenepropanoic acid,L-α-Hydrazino-α-methyl-3,4-dihydroxyphenylpropionic acid,L-α-Hydrazino-α-methyl-β-(3,4-dihydroxyphenyl)propionic acid,L-α-Methyl-α-hydrazino-3,4-dihydroxyphenylpropionic acid,L-α-Methyl-α-hydrazino-β-(3,4-dihydroxyphenyl)propionic acid,L-α-Methyl-β-(3,4-dihydroxyphenyl)-α-hydrazinopropionic acid,L-α-Methyldopahydrazine,Cabidopa,Carbidopa,HMD,Hydrazino-α-methyldopa,Lodosin,Lodosyn,MK 486,N-Aminomethyldopa,α-Hydrazino-α-methyl-β-(3,4-dihydroxyphenyl)propionic acid,α-Methyldopahydrazine IUPAC Name: (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid SMILES: C[C@@](Cc1ccc(O)c(O)c1)(NN)C(=O)O

CAS 28860-95-9
Molecular Weight (g/mol) 226.23
SMILES C[C@@](Cc1ccc(O)c(O)c1)(NN)C(=O)O
Synonym (αS)-α-Hydrazinyl-3,4-dihydroxy-α-methylbenzenepropanoic acid (ACI),Benzenepropanoic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, (S)- (ZCI),Benzenepropanoic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, (αS)- (9CI),Hydrocinnamic acid, α-hydrazino-3,4-dihydroxy-α-methyl-, L- (8CI),(-)-L-α-Hydrazino-3,4-dihydroxy-α-methylhydrocinamic acid,(-)-L-α-Hydrazino-3,4-dihydroxy-α-methylhydrocinnamic acid monohydrate,(2S)-2-(Aminoazaniumyl)-3-(3,4-dihydroxyphenyl)-2-methylpropanoate,(2S)-3-(3,4-Dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid,(S)-Carbidopa,1-α-(3,4-Dihydroxybenzyl)-α-hydrazinopropionic acid,L-3-(3,4-Dihydroxyphenyl)-2-methyl-2-hydrazinopropionic acid,L-Carbidopa,L-α-(3,4-Dihydroxybenzyl)-α-hydrazinopropionic acid,L-α-Hydrazino-3,4-dihydroxy-α-methylbenzenepropanoic acid,L-α-Hydrazino-α-methyl-3,4-dihydroxyphenylpropionic acid,L-α-Hydrazino-α-methyl-β-(3,4-dihydroxyphenyl)propionic acid,L-α-Methyl-α-hydrazino-3,4-dihydroxyphenylpropionic acid,L-α-Methyl-α-hydrazino-β-(3,4-dihydroxyphenyl)propionic acid,L-α-Methyl-β-(3,4-dihydroxyphenyl)-α-hydrazinopropionic acid,L-α-Methyldopahydrazine,Cabidopa,Carbidopa,HMD,Hydrazino-α-methyldopa,Lodosin,Lodosyn,MK 486,N-Aminomethyldopa,α-Hydrazino-α-methyl-β-(3,4-dihydroxyphenyl)propionic acid,α-Methyldopahydrazine
IUPAC Name (2S)-3-(3,4-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid
Molecular Formula C10 H14 N2 O4
7

(S)-(+)-Ibuprofen, TRC

CAS: 51146-56-6 Molecular Formula: C13 H18 O2 Molecular Weight (g/mol): 206.28 Synonym: Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (αS)-,Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (S)-,(+)-(S)-Ibuprofen,(+)-(S)-p-Isobutylhydratropic acid,(+)-Ibuprofen,(+)-Ibuprophen,(+)-α-Methyl-4-(2-methylpropyl)benzeneacetic acid,(S)-(+)-2-(4-Isobutylphenyl)propionic acid,(S)-(+)-4-Isobutyl-α-methylphenylacetic acid,(S)-(+)-Ibuprofen,(S)-(+)-p-Isobutylhydratropic acid,(S)-2-(4-Isobutylphenyl)propanoic acid,(S)-2-(4-Isobutylphenyl)propionic acid,(S)-2-(p-Isobutylphenyl)propionic acid,(S)-Ibuprofen,(αS)-α-Methyl-4-(2-methylpropyl)benzeneacetic acid,Dexibuprofen,Nyfen,S-Optifen,Seractil,Ultraprofen,d-Ibuprofen IUPAC Name: (2S)-2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)Cc1ccc(cc1)[C@H](C)C(=O)O

CAS 51146-56-6
Molecular Weight (g/mol) 206.28
SMILES CC(C)Cc1ccc(cc1)[C@H](C)C(=O)O
Synonym Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (αS)-,Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (S)-,(+)-(S)-Ibuprofen,(+)-(S)-p-Isobutylhydratropic acid,(+)-Ibuprofen,(+)-Ibuprophen,(+)-α-Methyl-4-(2-methylpropyl)benzeneacetic acid,(S)-(+)-2-(4-Isobutylphenyl)propionic acid,(S)-(+)-4-Isobutyl-α-methylphenylacetic acid,(S)-(+)-Ibuprofen,(S)-(+)-p-Isobutylhydratropic acid,(S)-2-(4-Isobutylphenyl)propanoic acid,(S)-2-(4-Isobutylphenyl)propionic acid,(S)-2-(p-Isobutylphenyl)propionic acid,(S)-Ibuprofen,(αS)-α-Methyl-4-(2-methylpropyl)benzeneacetic acid,Dexibuprofen,Nyfen,S-Optifen,Seractil,Ultraprofen,d-Ibuprofen
IUPAC Name (2S)-2-[4-(2-methylpropyl)phenyl]propanoic acid
Molecular Formula C13 H18 O2
8

(R)-(-)-Ibuprofen (S)-(+)-Lysinate, TRC

CAS: 157369-85-2 Molecular Formula: C13 H18 O2 . C6 H14 N2 O2 Molecular Weight (g/mol): 352.47 Synonym: L-Lysine, mono[(αR)-α-methyl-4-(2-methylpropyl)benzeneacetate] (9CI),L-Lysine, mono[(R)-α-methyl-4-(2-methylpropyl)benzeneacetate] (ZCI),Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (R)-, compd. with L-lysine (1:1) (9CI),R-(-)-Ibuprofen L-lysine salt,(R)-Ibuprofen lysinate,(R)-Ibuprofen lysine IUPAC Name: (2S)-2,6-diaminohexanoic acid;(2R)-2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)Cc1ccc(cc1)[C@@H](C)C(=O)O.NCCCC[C@H](N)C(=O)O

CAS 157369-85-2
Molecular Weight (g/mol) 352.47
SMILES CC(C)Cc1ccc(cc1)[C@@H](C)C(=O)O.NCCCC[C@H](N)C(=O)O
Synonym L-Lysine, mono[(αR)-α-methyl-4-(2-methylpropyl)benzeneacetate] (9CI),L-Lysine, mono[(R)-α-methyl-4-(2-methylpropyl)benzeneacetate] (ZCI),Benzeneacetic acid, α-methyl-4-(2-methylpropyl)-, (R)-, compd. with L-lysine (1:1) (9CI),R-(-)-Ibuprofen L-lysine salt,(R)-Ibuprofen lysinate,(R)-Ibuprofen lysine
IUPAC Name (2S)-2,6-diaminohexanoic acid;(2R)-2-[4-(2-methylpropyl)phenyl]propanoic acid
Molecular Formula C13 H18 O2 . C6 H14 N2 O2
9

2-Bromo (S)-Carbidopa, TRC

CAS: 43197-33-7 Molecular Formula: C10H13BrN2O4 Molecular Weight (g/mol): 305.13 Synonym: (S)-2-Bromo-alpha-hydrazino-4,5-dihydroxy-alpha-methylbenzenepropanoic Acid IUPAC Name: (2S)-3-(2-bromo-4,5-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid SMILES: C[C@@](Cc1cc(O)c(O)cc1Br)(NN)C(=O)O

CAS 43197-33-7
Molecular Weight (g/mol) 305.13
SMILES C[C@@](Cc1cc(O)c(O)cc1Br)(NN)C(=O)O
Synonym (S)-2-Bromo-alpha-hydrazino-4,5-dihydroxy-alpha-methylbenzenepropanoic Acid
IUPAC Name (2S)-3-(2-bromo-4,5-dihydroxyphenyl)-2-hydrazinyl-2-methylpropanoic acid
Molecular Formula C10H13BrN2O4
10

L-(-)-3-Phenyllactic acid, 98%

CAS: 20312-36-1 Molecular Formula: C9H9O3 Molecular Weight (g/mol): 165.17 MDL Number: MFCD00004244 InChI Key: VOXXWSYKYCBWHO-QMMMGPOBSA-M Synonym: l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid PubChem CID: 444718 ChEBI: CHEBI:43065 IUPAC Name: (2S)-2-hydroxy-3-phenylpropanoic acid SMILES: O[C@@H](CC1=CC=CC=C1)C([O-])=O

PubChem CID 444718
CAS 20312-36-1
Molecular Weight (g/mol) 165.17
ChEBI CHEBI:43065
MDL Number MFCD00004244
SMILES O[C@@H](CC1=CC=CC=C1)C([O-])=O
Synonym l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid
IUPAC Name (2S)-2-hydroxy-3-phenylpropanoic acid
InChI Key VOXXWSYKYCBWHO-QMMMGPOBSA-M
Molecular Formula C9H9O3
11

L(-)-3-Phenyllactic acid, 98%

CAS: 20312-36-1 Molecular Formula: C9H9O3 Molecular Weight (g/mol): 165.17 MDL Number: MFCD00004244 InChI Key: VOXXWSYKYCBWHO-QMMMGPOBSA-M Synonym: l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid PubChem CID: 444718 ChEBI: CHEBI:43065 IUPAC Name: (2S)-2-hydroxy-3-phenylpropanoic acid SMILES: O[C@@H](CC1=CC=CC=C1)C([O-])=O

PubChem CID 444718
CAS 20312-36-1
Molecular Weight (g/mol) 165.17
ChEBI CHEBI:43065
MDL Number MFCD00004244
SMILES O[C@@H](CC1=CC=CC=C1)C([O-])=O
Synonym l---3-phenyllactic acid,s-2-hydroxy-3-phenylpropionic acid,s-2-hydroxy-3-phenylpropanoic acid,l--3-phenyllactic acid,s---3-phenyllactic acid,l-3-phenyllactic acid,d-3-phenyllactic acid,2s-2-hydroxy-3-phenylpropanoic acid,s-3-phenyllactic acid,s---2-hydroxy-3-phenylpropionic acid
IUPAC Name (2S)-2-hydroxy-3-phenylpropanoic acid
InChI Key VOXXWSYKYCBWHO-QMMMGPOBSA-M
Molecular Formula C9H9O3
12

(S)-(+)-2-Phenylpropionic acid, 99%

CAS: 7782-24-3 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00063139 InChI Key: YPGCWEMNNLXISK-ZETCQYMHSA-N Synonym: s-+-2-phenylpropionic acid,s-2-phenylpropanoic acid,2s-2-phenylpropanoic acid,s-hydratropic acid,+-hydratropic acid,s-2-phenyl-propionic acid,s-alpha-methylbenzeneacetic acid,s-2-phenylpropionic acid,s-+-hydratropic acid,unii-988109nfbc PubChem CID: 2724622 ChEBI: CHEBI:48527 IUPAC Name: (2S)-2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O

PubChem CID 2724622
CAS 7782-24-3
Molecular Weight (g/mol) 150.18
ChEBI CHEBI:48527
MDL Number MFCD00063139
SMILES CC(C1=CC=CC=C1)C(=O)O
Synonym s-+-2-phenylpropionic acid,s-2-phenylpropanoic acid,2s-2-phenylpropanoic acid,s-hydratropic acid,+-hydratropic acid,s-2-phenyl-propionic acid,s-alpha-methylbenzeneacetic acid,s-2-phenylpropionic acid,s-+-hydratropic acid,unii-988109nfbc
IUPAC Name (2S)-2-phenylpropanoic acid
InChI Key YPGCWEMNNLXISK-ZETCQYMHSA-N
Molecular Formula C9H10O2
13

(S)-alpha-Methylphenylalanine hydrate, 98%, 98% ee, Thermo Scientific™

CAS: 23239-35-2 Molecular Formula: C10H13NO2·xH2O Molecular Weight (g/mol): 179.22 InChI Key: HYOWVAAEQCNGLE-JTQLQIEISA-N Synonym: alpha-methyl-l-phenylalanine,s-2-amino-2-methyl-3-phenylpropanoic acid,alpha-methyl-l-phe,alpha-methylphenylalanine,2s-2-amino-2-methyl-3-phenylpropanoic acid,l-alpha-methylphenylalanine,alpha-benzyl-l-ala,s-2-amino-2-methyl-3-phenylpropionic acid,s-2-amimo-2-methyl-3-phenylpropanoic acid,s-alpha-methylphenylalanine PubChem CID: 2724754 IUPAC Name: (2S)-2-amino-2-methyl-3-phenylpropanoic acid SMILES: CC(CC1=CC=CC=C1)(C(=O)O)N

PubChem CID 2724754
CAS 23239-35-2
Molecular Weight (g/mol) 179.22
SMILES CC(CC1=CC=CC=C1)(C(=O)O)N
Synonym alpha-methyl-l-phenylalanine,s-2-amino-2-methyl-3-phenylpropanoic acid,alpha-methyl-l-phe,alpha-methylphenylalanine,2s-2-amino-2-methyl-3-phenylpropanoic acid,l-alpha-methylphenylalanine,alpha-benzyl-l-ala,s-2-amino-2-methyl-3-phenylpropionic acid,s-2-amimo-2-methyl-3-phenylpropanoic acid,s-alpha-methylphenylalanine
IUPAC Name (2S)-2-amino-2-methyl-3-phenylpropanoic acid
InChI Key HYOWVAAEQCNGLE-JTQLQIEISA-N
Molecular Formula C10H13NO2·xH2O
14

2-Benzyl-N-Boc-D-proline, 95%, Thermo Scientific™

CAS: 706806-61-3 Molecular Formula: C17H23NO4 Molecular Weight (g/mol): 305.374 MDL Number: MFCD06659153 InChI Key: JUUNPRGYFCIXSM-KRWDZBQOSA-N Synonym: s-2-benzyl-1-tert-butoxycarbonyl pyrrolidine-2-carboxylic acid,boc-s-alpha-benzyl-proline,boc-s-a-benzylproline,s-2-benzyl-1-boc-2-pyrrolidinecarboxylic acid,2s-2-benzyl-1-tert-butoxycarbonyl pyrrolidine-2-carboxylic acid,boc-,a-benzyl-d-proline,2-benzyl-n-boc-d-proline,boc-s-,a-benzyl-pro-oh,boc-s-alpha-benzyl-pro-oh,2-benzyl-1-tert-butoxycarbonyl-d-proline PubChem CID: 6950294 IUPAC Name: (2S)-2-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid SMILES: CC(C)(C)OC(=O)N1CCCC1(CC2=CC=CC=C2)C(=O)O

PubChem CID 6950294
CAS 706806-61-3
Molecular Weight (g/mol) 305.374
MDL Number MFCD06659153
SMILES CC(C)(C)OC(=O)N1CCCC1(CC2=CC=CC=C2)C(=O)O
Synonym s-2-benzyl-1-tert-butoxycarbonyl pyrrolidine-2-carboxylic acid,boc-s-alpha-benzyl-proline,boc-s-a-benzylproline,s-2-benzyl-1-boc-2-pyrrolidinecarboxylic acid,2s-2-benzyl-1-tert-butoxycarbonyl pyrrolidine-2-carboxylic acid,boc-,a-benzyl-d-proline,2-benzyl-n-boc-d-proline,boc-s-,a-benzyl-pro-oh,boc-s-alpha-benzyl-pro-oh,2-benzyl-1-tert-butoxycarbonyl-d-proline
IUPAC Name (2S)-2-benzyl-1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidine-2-carboxylic acid
InChI Key JUUNPRGYFCIXSM-KRWDZBQOSA-N
Molecular Formula C17H23NO4
15

3-(Boc-amino)-3-(3-fluorophenyl)propionic acid, 99%, Thermo Scientific™

CAS: 284493-59-0 Molecular Formula: C14H18FNO4 Molecular Weight (g/mol): 283.299 MDL Number: MFCD02090701 InChI Key: IQPQPXUDXQDVMK-UHFFFAOYSA-N Synonym: 3-tert-butoxycarbonyl amino-3-3-fluorophenyl propanoic acid,3-boc-amino-3-3-fluorophenyl propionic acid,3-n-boc-amino-3-3-fluorophenyl propionic acid,3-3-fluorophenyl-3-2-methylpropan-2-yl oxycarbonylamino propanoic acid,boc-3-amino-3-3-fluorophenyl propionic acid,3-tert-butoxy carbonylamino-3-3-fluorophenyl propanoic acid,acmc-20anb3,boc-r-3-amino-3-3-fluoro-phenyl-propionic acid,r,s-3-amino-3-3-fluorophenyl propanoic acid PubChem CID: 2783065 IUPAC Name: 3-(3-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid SMILES: CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)F

PubChem CID 2783065
CAS 284493-59-0
Molecular Weight (g/mol) 283.299
MDL Number MFCD02090701
SMILES CC(C)(C)OC(=O)NC(CC(=O)O)C1=CC(=CC=C1)F
Synonym 3-tert-butoxycarbonyl amino-3-3-fluorophenyl propanoic acid,3-boc-amino-3-3-fluorophenyl propionic acid,3-n-boc-amino-3-3-fluorophenyl propionic acid,3-3-fluorophenyl-3-2-methylpropan-2-yl oxycarbonylamino propanoic acid,boc-3-amino-3-3-fluorophenyl propionic acid,3-tert-butoxy carbonylamino-3-3-fluorophenyl propanoic acid,acmc-20anb3,boc-r-3-amino-3-3-fluoro-phenyl-propionic acid,r,s-3-amino-3-3-fluorophenyl propanoic acid
IUPAC Name 3-(3-fluorophenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
InChI Key IQPQPXUDXQDVMK-UHFFFAOYSA-N
Molecular Formula C14H18FNO4