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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 – 15 of 107 results
1

4-Isobutyl-alpha-methylphenylacetic acid, 99%

CAS: 15687-27-1 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.29 MDL Number: MFCD00010393 InChI Key: HEFNNWSXXWATRW-UHFFFAOYNA-N Synonym: ibuprofen,2-4-isobutylphenyl propanoic acid,motrin,brufen,nurofen,advil,dolgit,liptan,nuprin,anflagen PubChem CID: 3672 ChEBI: CHEBI:5855 IUPAC Name: 2-[4-(2-methylpropyl)phenyl]propanoic acid SMILES: CC(C)CC1=CC=C(C=C1)C(C)C(O)=O

EDGE
PubChem CID 3672
CAS 15687-27-1
Molecular Weight (g/mol) 206.29
ChEBI CHEBI:5855
MDL Number MFCD00010393
SMILES CC(C)CC1=CC=C(C=C1)C(C)C(O)=O
Synonym ibuprofen,2-4-isobutylphenyl propanoic acid,motrin,brufen,nurofen,advil,dolgit,liptan,nuprin,anflagen
IUPAC Name 2-[4-(2-methylpropyl)phenyl]propanoic acid
InChI Key HEFNNWSXXWATRW-UHFFFAOYNA-N
Molecular Formula C13H18O2
2

4-Chloro-alpha-methylphenylacetic acid, 97%

CAS: 938-95-4 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00044670 InChI Key: YOZILQVNIWNPFP-UHFFFAOYSA-N Synonym: 2-4-chlorophenyl propanoic acid,4-chloro-alpha-methylphenylacetic acid,dl-2-4-chlorophenyl propan-oic acid,dl-p-chloro-.alpha.-methylphenylacetic acid,benzeneacetic acid, 4-chloro-.alpha.-methyl,dl-2-4-chlorophenyl propanoic acid,2-4-chloro-phenyl-propionic acid,dl-4-chloro-alpha-methylphenylacetic acid,?-p-chlorohydratropic acid,4-chloro methylphenylacetic acid PubChem CID: 102525 IUPAC Name: 2-(4-chlorophenyl)propanoic acid SMILES: CC(C1=CC=C(C=C1)Cl)C(=O)O

PubChem CID 102525
CAS 938-95-4
Molecular Weight (g/mol) 184.619
MDL Number MFCD00044670
SMILES CC(C1=CC=C(C=C1)Cl)C(=O)O
Synonym 2-4-chlorophenyl propanoic acid,4-chloro-alpha-methylphenylacetic acid,dl-2-4-chlorophenyl propan-oic acid,dl-p-chloro-.alpha.-methylphenylacetic acid,benzeneacetic acid, 4-chloro-.alpha.-methyl,dl-2-4-chlorophenyl propanoic acid,2-4-chloro-phenyl-propionic acid,dl-4-chloro-alpha-methylphenylacetic acid,?-p-chlorohydratropic acid,4-chloro methylphenylacetic acid
IUPAC Name 2-(4-chlorophenyl)propanoic acid
InChI Key YOZILQVNIWNPFP-UHFFFAOYSA-N
Molecular Formula C9H9ClO2
3

3-(3,4-Dihydroxyphenyl)propionic acid, 98+%

CAS: 1078-61-1 Molecular Formula: C9H10O4 Molecular Weight (g/mol): 182.175 MDL Number: MFCD00002776 InChI Key: DZAUWHJDUNRCTF-UHFFFAOYSA-N Synonym: dihydrocaffeic acid,3-3,4-dihydroxyphenyl propionic acid,hydrocaffeic acid,3,4-dihydroxyhydrocinnamic acid,3-3,4-dihydroxyphenyl propanoic acid,benzenepropanoic acid, 3,4-dihydroxy,hydrocaffeic acid polymer,hykop,3,4-dihydroxyhydrocinnamate,3,4-dihydroxybenzenepropionic acid PubChem CID: 348154 ChEBI: CHEBI:48400 IUPAC Name: 3-(3,4-dihydroxyphenyl)propanoic acid SMILES: C1=CC(=C(C=C1CCC(=O)O)O)O

PubChem CID 348154
CAS 1078-61-1
Molecular Weight (g/mol) 182.175
ChEBI CHEBI:48400
MDL Number MFCD00002776
SMILES C1=CC(=C(C=C1CCC(=O)O)O)O
Synonym dihydrocaffeic acid,3-3,4-dihydroxyphenyl propionic acid,hydrocaffeic acid,3,4-dihydroxyhydrocinnamic acid,3-3,4-dihydroxyphenyl propanoic acid,benzenepropanoic acid, 3,4-dihydroxy,hydrocaffeic acid polymer,hykop,3,4-dihydroxyhydrocinnamate,3,4-dihydroxybenzenepropionic acid
IUPAC Name 3-(3,4-dihydroxyphenyl)propanoic acid
InChI Key DZAUWHJDUNRCTF-UHFFFAOYSA-N
Molecular Formula C9H10O4
4

(+/-)-2-Phenylpropionic acid, 98%

CAS: 492-37-5 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.177 MDL Number: MFCD00002650 InChI Key: YPGCWEMNNLXISK-UHFFFAOYSA-N Synonym: 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid PubChem CID: 10296 ChEBI: CHEBI:48526 IUPAC Name: 2-phenylpropanoic acid SMILES: CC(C1=CC=CC=C1)C(=O)O

PubChem CID 10296
CAS 492-37-5
Molecular Weight (g/mol) 150.177
ChEBI CHEBI:48526
MDL Number MFCD00002650
SMILES CC(C1=CC=CC=C1)C(=O)O
Synonym 2-phenylpropionic acid,hydratropic acid,dl-2-phenylpropionic acid,alpha-methylphenylacetic acid,2-phenyl-propionic acid,+/--2-phenylpropionic acid,alpha-methylbenzeneacetic acid,benzeneacetic acid, .alpha.-methyl,hydratropasaeure,alpha-phenylpropionic acid
IUPAC Name 2-phenylpropanoic acid
InChI Key YPGCWEMNNLXISK-UHFFFAOYSA-N
Molecular Formula C9H10O2
5

(+/-)-Phenylsuccinic acid, 98%

CAS: 635-51-8 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00004256 InChI Key: LVFFZQQWIZURIO-UHFFFAOYSA-N Synonym: phenylsuccinic acid,dl-phenylsuccinic acid,2-phenylsuccinic acid,phenyl succinic acid,butanedioic acid, phenyl,succinic acid, phenyl,2-phenylsuccinate,.alpha.-phenylsuccinic acid,phenylsuccinate,butanedioic acid, 2-phenyl PubChem CID: 95459 IUPAC Name: 2-phenylbutanedioic acid SMILES: C1=CC=C(C=C1)C(CC(=O)O)C(=O)O

PubChem CID 95459
CAS 635-51-8
Molecular Weight (g/mol) 194.186
MDL Number MFCD00004256
SMILES C1=CC=C(C=C1)C(CC(=O)O)C(=O)O
Synonym phenylsuccinic acid,dl-phenylsuccinic acid,2-phenylsuccinic acid,phenyl succinic acid,butanedioic acid, phenyl,succinic acid, phenyl,2-phenylsuccinate,.alpha.-phenylsuccinic acid,phenylsuccinate,butanedioic acid, 2-phenyl
IUPAC Name 2-phenylbutanedioic acid
InChI Key LVFFZQQWIZURIO-UHFFFAOYSA-N
Molecular Formula C10H10O4
6

(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
7

3,5-Di-tert-butyl-4-hydroxyphenylpropionic acid, 98%

CAS: 20170-32-5 MDL Number: MFCD00017519 Synonym: 3-3,5-di-tert-butyl-4-hydroxyphenyl propionic acid,3-3,5-di-tert-butyl-4-hydroxyphenyl propanoic acid,fenozan,3,5-di-tert-butyl-4-hydroxyphenylpropionic acid,benzenepropanoic acid, 3,5-bis 1,1-dimethylethyl-4-hydroxy,unii-x6g09g700f,3,5-di-tert-butyl-4-hydroxyhydocinnamic acid,3,5-bis 1,1-dimethylethyl-4-hydroxybenzenepropanoic acid,3-3,5-ditertbutyl-4-hydroxyphenyl propionic acid,3-3,5-bis tert-butyl-4-hydroxyphenyl propanoic acid PubChem CID: 88389 IUPAC Name: 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid

PubChem CID 88389
CAS 20170-32-5
MDL Number MFCD00017519
Synonym 3-3,5-di-tert-butyl-4-hydroxyphenyl propionic acid,3-3,5-di-tert-butyl-4-hydroxyphenyl propanoic acid,fenozan,3,5-di-tert-butyl-4-hydroxyphenylpropionic acid,benzenepropanoic acid, 3,5-bis 1,1-dimethylethyl-4-hydroxy,unii-x6g09g700f,3,5-di-tert-butyl-4-hydroxyhydocinnamic acid,3,5-bis 1,1-dimethylethyl-4-hydroxybenzenepropanoic acid,3-3,5-ditertbutyl-4-hydroxyphenyl propionic acid,3-3,5-bis tert-butyl-4-hydroxyphenyl propanoic acid
IUPAC Name 3-(3,5-ditert-butyl-4-hydroxyphenyl)propanoic acid
8

3-(3-Methoxyphenyl)propionic acid, 98+%

CAS: 10516-71-9 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.20 MDL Number: MFCD00014027 InChI Key: BJJQJLOZWBZEGA-UHFFFAOYSA-N Synonym: 3-3-methoxyphenyl propionic acid,3-3-methoxyphenyl propanoic acid,3-m-methoxyphenyl propionic acid,3-methoxybenzenepropanoic acid,benzenepropanoic acid, 3-methoxy,3-3-methoxy-phenyl-propionic acid,3-methoxy-benzenepropanoic acid,3-3-methoxyphenyl propanoate,m-methoxyhydrocinnamate,3-methoxydihydrocinnamate PubChem CID: 66336 IUPAC Name: 3-(3-methoxyphenyl)propanoic acid SMILES: COC1=CC=CC(CCC(O)=O)=C1

PubChem CID 66336
CAS 10516-71-9
Molecular Weight (g/mol) 180.20
MDL Number MFCD00014027
SMILES COC1=CC=CC(CCC(O)=O)=C1
Synonym 3-3-methoxyphenyl propionic acid,3-3-methoxyphenyl propanoic acid,3-m-methoxyphenyl propionic acid,3-methoxybenzenepropanoic acid,benzenepropanoic acid, 3-methoxy,3-3-methoxy-phenyl-propionic acid,3-methoxy-benzenepropanoic acid,3-3-methoxyphenyl propanoate,m-methoxyhydrocinnamate,3-methoxydihydrocinnamate
IUPAC Name 3-(3-methoxyphenyl)propanoic acid
InChI Key BJJQJLOZWBZEGA-UHFFFAOYSA-N
Molecular Formula C10H12O3
9

4-(2-Carboxyethyl)benzeneboronic acid, 97%

CAS: 166316-48-9 Molecular Formula: C9H11BO4 Molecular Weight (g/mol): 193.993 MDL Number: MFCD01318119 InChI Key: VPSARXNVXCRDIV-UHFFFAOYSA-N Synonym: 3-4-boronophenyl propanoic acid,4-2-carboxyethyl phenylboronic acid,4-2-carboxyethyl benzeneboronic acid,3-4-boronophenyl propionic acid,3-4-dihydroxyboranyl phenyl propanoic acid,acmc-209dty,benzenepropanoic acid,4-borono,3-4-boronophenyl-propanoic acid,4-borono-benzenepropanoic acid,4-2-carboxyethyl phenyl boronic acid PubChem CID: 3863484 IUPAC Name: 3-(4-boronophenyl)propanoic acid SMILES: B(C1=CC=C(C=C1)CCC(=O)O)(O)O

PubChem CID 3863484
CAS 166316-48-9
Molecular Weight (g/mol) 193.993
MDL Number MFCD01318119
SMILES B(C1=CC=C(C=C1)CCC(=O)O)(O)O
Synonym 3-4-boronophenyl propanoic acid,4-2-carboxyethyl phenylboronic acid,4-2-carboxyethyl benzeneboronic acid,3-4-boronophenyl propionic acid,3-4-dihydroxyboranyl phenyl propanoic acid,acmc-209dty,benzenepropanoic acid,4-borono,3-4-boronophenyl-propanoic acid,4-borono-benzenepropanoic acid,4-2-carboxyethyl phenyl boronic acid
IUPAC Name 3-(4-boronophenyl)propanoic acid
InChI Key VPSARXNVXCRDIV-UHFFFAOYSA-N
Molecular Formula C9H11BO4
10

3-[4-(Benzyloxy)phenyl]propionic acid, 96%

CAS: 50463-48-4 Molecular Formula: C16H16O3 Molecular Weight (g/mol): 256.301 MDL Number: MFCD01570264 InChI Key: QTSAUVQZNADEKS-UHFFFAOYSA-N Synonym: 3-4-benzyloxyphenyl propionic acid,3-4-benzyloxy phenyl propanoic acid,3-4-benzyloxy phenyl propionic acid,benzyloxyphenylpropanoic acid,3-4-benzyloxyphenyl propanoic acid,3-4-benzyloxy-phenyl-propionic acid,benzenepropanoic acid, 4-phenylmethoxy,maybridge3_003480,4-benzyloxy benzenepropanoic acid PubChem CID: 561372 IUPAC Name: 3-(4-phenylmethoxyphenyl)propanoic acid SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)CCC(=O)O

PubChem CID 561372
CAS 50463-48-4
Molecular Weight (g/mol) 256.301
MDL Number MFCD01570264
SMILES C1=CC=C(C=C1)COC2=CC=C(C=C2)CCC(=O)O
Synonym 3-4-benzyloxyphenyl propionic acid,3-4-benzyloxy phenyl propanoic acid,3-4-benzyloxy phenyl propionic acid,benzyloxyphenylpropanoic acid,3-4-benzyloxyphenyl propanoic acid,3-4-benzyloxy-phenyl-propionic acid,benzenepropanoic acid, 4-phenylmethoxy,maybridge3_003480,4-benzyloxy benzenepropanoic acid
IUPAC Name 3-(4-phenylmethoxyphenyl)propanoic acid
InChI Key QTSAUVQZNADEKS-UHFFFAOYSA-N
Molecular Formula C16H16O3
11

3-(4-tert-Butylphenyl)propionic acid, 97%

CAS: 1208-64-6 Molecular Formula: C13H18O2 Molecular Weight (g/mol): 206.285 MDL Number: MFCD00796482 InChI Key: BNJYANVQFVSYEK-UHFFFAOYSA-N Synonym: 3-4-tert-butyl-phenyl-propionic acid,3-4-tert-butyl phenyl propanoic acid,3-4-tert-butylphenyl propanoic acid,4-1,1-dimethylethyl benzenepropanoic acid,4-t-butylhydrocinnamic acid,4-t-butylhydrocinnamic aicd,4-tert-butylhydrocinnamic acid,3-4-t-butylphenyl propionic acid,3-4-t-butylphenyl propanoic acid PubChem CID: 4962173 IUPAC Name: 3-(4-tert-butylphenyl)propanoic acid SMILES: CC(C)(C)C1=CC=C(C=C1)CCC(=O)O

PubChem CID 4962173
CAS 1208-64-6
Molecular Weight (g/mol) 206.285
MDL Number MFCD00796482
SMILES CC(C)(C)C1=CC=C(C=C1)CCC(=O)O
Synonym 3-4-tert-butyl-phenyl-propionic acid,3-4-tert-butyl phenyl propanoic acid,3-4-tert-butylphenyl propanoic acid,4-1,1-dimethylethyl benzenepropanoic acid,4-t-butylhydrocinnamic acid,4-t-butylhydrocinnamic aicd,4-tert-butylhydrocinnamic acid,3-4-t-butylphenyl propionic acid,3-4-t-butylphenyl propanoic acid
IUPAC Name 3-(4-tert-butylphenyl)propanoic acid
InChI Key BNJYANVQFVSYEK-UHFFFAOYSA-N
Molecular Formula C13H18O2
12

3-(2,5-Dimethoxyphenyl)propionic acid, 96%

CAS: 10538-49-5 Molecular Formula: C11H14O4 Molecular Weight (g/mol): 210.23 MDL Number: MFCD00060325 InChI Key: JENQUCZZZGYHRW-UHFFFAOYSA-N PubChem CID: 66343 IUPAC Name: 3-(2,5-dimethoxyphenyl)propanoic acid SMILES: COC1=CC=C(OC)C(CCC(O)=O)=C1

PubChem CID 66343
CAS 10538-49-5
Molecular Weight (g/mol) 210.23
MDL Number MFCD00060325
SMILES COC1=CC=C(OC)C(CCC(O)=O)=C1
IUPAC Name 3-(2,5-dimethoxyphenyl)propanoic acid
InChI Key JENQUCZZZGYHRW-UHFFFAOYSA-N
Molecular Formula C11H14O4
13

3-(4-Methoxyphenyl)propionic acid, 98%

CAS: 1929-29-9 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00002777 InChI Key: FIUFLISGGHNPSM-UHFFFAOYSA-N Synonym: 3-4-methoxyphenyl propanoic acid,3-4-methoxyphenyl propionic acid,benzenepropanoic acid, 4-methoxy,p-methoxyhydrocinnamic acid,3-p-methoxyphenyl propionic acid,3-4-methoxy-phenyl-propionic acid,4-methoxyhydrocinnamic acid,3-4-methoxyphenyl-propionic acid,4-methoxyhydro cinnamic acid,hydrocinnamic acid, p-methoxy PubChem CID: 95750 IUPAC Name: 3-(4-methoxyphenyl)propanoic acid SMILES: COC1=CC=C(C=C1)CCC(=O)O

PubChem CID 95750
CAS 1929-29-9
Molecular Weight (g/mol) 180.203
MDL Number MFCD00002777
SMILES COC1=CC=C(C=C1)CCC(=O)O
Synonym 3-4-methoxyphenyl propanoic acid,3-4-methoxyphenyl propionic acid,benzenepropanoic acid, 4-methoxy,p-methoxyhydrocinnamic acid,3-p-methoxyphenyl propionic acid,3-4-methoxy-phenyl-propionic acid,4-methoxyhydrocinnamic acid,3-4-methoxyphenyl-propionic acid,4-methoxyhydro cinnamic acid,hydrocinnamic acid, p-methoxy
IUPAC Name 3-(4-methoxyphenyl)propanoic acid
InChI Key FIUFLISGGHNPSM-UHFFFAOYSA-N
Molecular Formula C10H12O3
14

3-(4-Chloro-3-fluorophenyl)propionic acid, 96%

CAS: 881189-65-7 Molecular Formula: C9H8ClFO2 Molecular Weight (g/mol): 202.609 MDL Number: MFCD04116058 InChI Key: GDXMVKNNJGWZFN-UHFFFAOYSA-N Synonym: 3-4-chloro-3-fluorophenyl propionic acid,3-4-chloro-3-fluorophenyl propanoic acid,benzenepropanoic acid, 4-chloro-3-fluoro,3-4-chloro-3-fluoro-phenyl-propionic acid,4-chloro-3-fluorobenzenepropanoic acid,3-4-chloro-3-fluorophenyl propionicacid PubChem CID: 4680108 IUPAC Name: 3-(4-chloro-3-fluorophenyl)propanoic acid SMILES: C1=CC(=C(C=C1CCC(=O)O)F)Cl

PubChem CID 4680108
CAS 881189-65-7
Molecular Weight (g/mol) 202.609
MDL Number MFCD04116058
SMILES C1=CC(=C(C=C1CCC(=O)O)F)Cl
Synonym 3-4-chloro-3-fluorophenyl propionic acid,3-4-chloro-3-fluorophenyl propanoic acid,benzenepropanoic acid, 4-chloro-3-fluoro,3-4-chloro-3-fluoro-phenyl-propionic acid,4-chloro-3-fluorobenzenepropanoic acid,3-4-chloro-3-fluorophenyl propionicacid
IUPAC Name 3-(4-chloro-3-fluorophenyl)propanoic acid
InChI Key GDXMVKNNJGWZFN-UHFFFAOYSA-N
Molecular Formula C9H8ClFO2