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Monocarboxylic acids and derivatives

Organic compounds that contain one carboxyl group; carboxyl groups consist of a carbonyl group bonded to a hydroxy group. Includes compounds that are derived from monocarboxylic acids.
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1 – 15 of 21 results
1

L-Lactic acid, anhydrous, 98%

CAS: 79-33-4 Molecular Formula: C3H6O3 Molecular Weight (g/mol): 90.078 MDL Number: MFCD00064266 InChI Key: JVTAAEKCZFNVCJ-REOHCLBHSA-N Synonym: l-lactic acid,l-+-lactic acid,s-2-hydroxypropanoic acid,s-lactic acid,sarcolactic acid,s-2-hydroxypropionic acid,2s-2-hydroxypropanoic acid,+-lactic acid,espiritin,tisulac PubChem CID: 107689 ChEBI: CHEBI:422 IUPAC Name: (2S)-2-hydroxypropanoic acid SMILES: CC(C(=O)O)O

EDGE
PubChem CID 107689
CAS 79-33-4
Molecular Weight (g/mol) 90.078
ChEBI CHEBI:422
MDL Number MFCD00064266
SMILES CC(C(=O)O)O
Synonym l-lactic acid,l-+-lactic acid,s-2-hydroxypropanoic acid,s-lactic acid,sarcolactic acid,s-2-hydroxypropionic acid,2s-2-hydroxypropanoic acid,+-lactic acid,espiritin,tisulac
IUPAC Name (2S)-2-hydroxypropanoic acid
InChI Key JVTAAEKCZFNVCJ-REOHCLBHSA-N
Molecular Formula C3H6O3
2

Ethyl myristate, 98+%

CAS: 124-06-1 Molecular Formula: C16H32O2 Molecular Weight (g/mol): 256.43 MDL Number: MFCD00008984 InChI Key: MMKRHZKQPFCLLS-UHFFFAOYSA-N Synonym: ethyl myristate,tetradecanoic acid, ethyl ester,myristic acid ethyl ester,myristic acid, ethyl ester,ethylmyristate,ethyl n-tetradecanoate,ethyl myristate natural,fema no. 2445,tetradecanoic acid ethyl ester,ethyl ester tetradecanoic acid PubChem CID: 31283 ChEBI: CHEBI:84849 IUPAC Name: ethyl tetradecanoate SMILES: CCCCCCCCCCCCCC(=O)OCC

PubChem CID 31283
CAS 124-06-1
Molecular Weight (g/mol) 256.43
ChEBI CHEBI:84849
MDL Number MFCD00008984
SMILES CCCCCCCCCCCCCC(=O)OCC
Synonym ethyl myristate,tetradecanoic acid, ethyl ester,myristic acid ethyl ester,myristic acid, ethyl ester,ethylmyristate,ethyl n-tetradecanoate,ethyl myristate natural,fema no. 2445,tetradecanoic acid ethyl ester,ethyl ester tetradecanoic acid
IUPAC Name ethyl tetradecanoate
InChI Key MMKRHZKQPFCLLS-UHFFFAOYSA-N
Molecular Formula C16H32O2
3

Ethyl pyruvate, 98%

CAS: 617-35-6 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.116 MDL Number: MFCD00009123 InChI Key: XXRCUYVCPSWGCC-UHFFFAOYSA-N Synonym: ethyl pyruvate,ethyl 2-oxopropionate,pyruvic acid, ethyl ester,propanoic acid, 2-oxo-, ethyl ester,pyruvic acid ethyl ester,ethyl pyroracemate,ethyl acetylformate,2-oxo-propionic acid ethyl ester,ethyl pyruvate natural,ethyl alpha-ketopropionate PubChem CID: 12041 IUPAC Name: ethyl 2-oxopropanoate SMILES: CCOC(=O)C(=O)C

PubChem CID 12041
CAS 617-35-6
Molecular Weight (g/mol) 116.116
MDL Number MFCD00009123
SMILES CCOC(=O)C(=O)C
Synonym ethyl pyruvate,ethyl 2-oxopropionate,pyruvic acid, ethyl ester,propanoic acid, 2-oxo-, ethyl ester,pyruvic acid ethyl ester,ethyl pyroracemate,ethyl acetylformate,2-oxo-propionic acid ethyl ester,ethyl pyruvate natural,ethyl alpha-ketopropionate
IUPAC Name ethyl 2-oxopropanoate
InChI Key XXRCUYVCPSWGCC-UHFFFAOYSA-N
Molecular Formula C5H8O3
4

(-)-Epicatechin gallate, Thermo Scientific Chemicals

CAS: 1257-08-5 Molecular Formula: C22H18O10 Molecular Weight (g/mol): 442.376 MDL Number: MFCD00075936 InChI Key: LSHVYAFMTMFKBA-TZIWHRDSSA-N Synonym: =--epicatechin gallate,epicatechin gallate,=--epicatechin-3-o-gallate,l-epicatechin gallate,=--epicatechin-3-gallate,=--epicatechingallate,epicatechin monogallate,--epicatechin 3-o-gallate,teatannin,epicatechol, gallate PubChem CID: 107905 ChEBI: CHEBI:70255 IUPAC Name: [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate SMILES: C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O

PubChem CID 107905
CAS 1257-08-5
Molecular Weight (g/mol) 442.376
ChEBI CHEBI:70255
MDL Number MFCD00075936
SMILES C1C(C(OC2=CC(=CC(=C21)O)O)C3=CC(=C(C=C3)O)O)OC(=O)C4=CC(=C(C(=C4)O)O)O
Synonym =--epicatechin gallate,epicatechin gallate,=--epicatechin-3-o-gallate,l-epicatechin gallate,=--epicatechin-3-gallate,=--epicatechingallate,epicatechin monogallate,--epicatechin 3-o-gallate,teatannin,epicatechol, gallate
IUPAC Name [(2R,3R)-2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,4-dihydro-2H-chromen-3-yl] 3,4,5-trihydroxybenzoate
InChI Key LSHVYAFMTMFKBA-TZIWHRDSSA-N
Molecular Formula C22H18O10
5

2-Naphthyl acetate, 99%

CAS: 1523-11-1 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00004060 InChI Key: RJNPPEUAJCEUPV-UHFFFAOYSA-N Synonym: 2-naphthyl acetate,2-acetoxynaphthalene,2-naphthalenol, acetate,beta-naphthyl acetate,2-naphthol, acetate,naphthalene, 2-acetoxy,2-naphthalenol, 2-acetate,.beta.-naphthol acetate,.beta.-naphthyl acetate,o-acetyl-.beta.-naphthol PubChem CID: 73709 IUPAC Name: naphthalen-2-yl acetate SMILES: CC(=O)OC1=CC=C2C=CC=CC2=C1

PubChem CID 73709
CAS 1523-11-1
Molecular Weight (g/mol) 186.21
MDL Number MFCD00004060
SMILES CC(=O)OC1=CC=C2C=CC=CC2=C1
Synonym 2-naphthyl acetate,2-acetoxynaphthalene,2-naphthalenol, acetate,beta-naphthyl acetate,2-naphthol, acetate,naphthalene, 2-acetoxy,2-naphthalenol, 2-acetate,.beta.-naphthol acetate,.beta.-naphthyl acetate,o-acetyl-.beta.-naphthol
IUPAC Name naphthalen-2-yl acetate
InChI Key RJNPPEUAJCEUPV-UHFFFAOYSA-N
Molecular Formula C12H10O2
6

2-(Fmoc-amino)isobutyric acid, 98%, Thermo Scientific Chemicals

CAS: 94744-50-0 Molecular Formula: C19H19NO4 Molecular Weight (g/mol): 325.36 MDL Number: MFCD00151913 InChI Key: HOZZVEPRYYCBTO-UHFFFAOYSA-N Synonym: fmoc-aib-oh,fmoc-alpha-methylalanine,fmoc-alpha-me-ala-oh,2-fmoc-amino isobutyric acid,2-9h-fluoren-9-yl methoxy carbonyl amino-2-methylpropanoic acid,alanine, n-9h-fluoren-9-ylmethoxy carbonyl-2-methyl,2-9h-fluoren-9-ylmethoxy carbonyl amino-2-methylpropanoic acid,n-fmoc-2-aminoisobutyric acid,2-9h-fluoren-9-ylmethoxy carbonylamino isobutyric acid PubChem CID: 2756096 SMILES: CC(C)(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O

PubChem CID 2756096
CAS 94744-50-0
Molecular Weight (g/mol) 325.36
MDL Number MFCD00151913
SMILES CC(C)(NC(=O)OCC1C2=CC=CC=C2C2=CC=CC=C12)C(O)=O
Synonym fmoc-aib-oh,fmoc-alpha-methylalanine,fmoc-alpha-me-ala-oh,2-fmoc-amino isobutyric acid,2-9h-fluoren-9-yl methoxy carbonyl amino-2-methylpropanoic acid,alanine, n-9h-fluoren-9-ylmethoxy carbonyl-2-methyl,2-9h-fluoren-9-ylmethoxy carbonyl amino-2-methylpropanoic acid,n-fmoc-2-aminoisobutyric acid,2-9h-fluoren-9-ylmethoxy carbonylamino isobutyric acid
InChI Key HOZZVEPRYYCBTO-UHFFFAOYSA-N
Molecular Formula C19H19NO4
7

Ethyl acetopyruvate, 98%

CAS: 615-79-2 Molecular Formula: C7H10O4 Molecular Weight (g/mol): 158.15 MDL Number: MFCD00009124 InChI Key: OYQVQWIASIXXRT-UHFFFAOYSA-N PubChem CID: 69208 IUPAC Name: ethyl 2,4-dioxopentanoate SMILES: CCOC(=O)C(=O)CC(C)=O

PubChem CID 69208
CAS 615-79-2
Molecular Weight (g/mol) 158.15
MDL Number MFCD00009124
SMILES CCOC(=O)C(=O)CC(C)=O
IUPAC Name ethyl 2,4-dioxopentanoate
InChI Key OYQVQWIASIXXRT-UHFFFAOYSA-N
Molecular Formula C7H10O4
8

2-Keto-D-gluconic acid hemicalcium salt monohydrate, 99%

CAS: 3470-37-9 Molecular Formula: C12H20CaO14 Molecular Weight (g/mol): 428.356 MDL Number: MFCD00149104 InChI Key: QACANIDDQFGAJU-JQTJLMCZSA-N Synonym: calcium 2-keto-d-gluconate PubChem CID: 131852723 IUPAC Name: calcium;(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexanoic acid SMILES: C(C(C(C(C(=O)C(=O)O)O)O)O)O.C(C(C(C(C(=O)C(=O)O)O)O)O)O.[Ca]

PubChem CID 131852723
CAS 3470-37-9
Molecular Weight (g/mol) 428.356
MDL Number MFCD00149104
SMILES C(C(C(C(C(=O)C(=O)O)O)O)O)O.C(C(C(C(C(=O)C(=O)O)O)O)O)O.[Ca]
Synonym calcium 2-keto-d-gluconate
IUPAC Name calcium;(3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexanoic acid
InChI Key QACANIDDQFGAJU-JQTJLMCZSA-N
Molecular Formula C12H20CaO14
9

Ethyl butyrate, 99%

CAS: 105-54-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009394 InChI Key: OBNCKNCVKJNDBV-UHFFFAOYSA-N Synonym: ethyl butyrate,butyric acid ethyl ester,ethyl n-butyrate,butanoic acid, ethyl ester,butyric ester,butyric ether,butyric acid, ethyl ester,ethyl n-butanoate,butanoic acid ethyl ester,fema number 2427 PubChem CID: 7762 IUPAC Name: ethyl butanoate SMILES: CCCC(=O)OCC

PubChem CID 7762
CAS 105-54-4
Molecular Weight (g/mol) 116.16
MDL Number MFCD00009394
SMILES CCCC(=O)OCC
Synonym ethyl butyrate,butyric acid ethyl ester,ethyl n-butyrate,butanoic acid, ethyl ester,butyric ester,butyric ether,butyric acid, ethyl ester,ethyl n-butanoate,butanoic acid ethyl ester,fema number 2427
IUPAC Name ethyl butanoate
InChI Key OBNCKNCVKJNDBV-UHFFFAOYSA-N
Molecular Formula C6H12O2
11

trans-Indole-3-acrylic acid, 98+%

CAS: 29953-71-7 Molecular Formula: C11H9NO2 Molecular Weight (g/mol): 187.198 MDL Number: MFCD00005633 InChI Key: PLVPPLCLBIEYEA-AATRIKPKSA-N Synonym: 3-indoleacrylic acid,trans-3-indoleacrylic acid,indole-3-acrylic acid,3-indolylacrylic acid,indole-3beta-acrylic acid,3-1h-indol-3-yl acrylic acid,indole-3-crylic acid,2e-3-1h-indol-3-yl prop-2-enoic acid,trans-3-1h-indol-3-yl acrylic acid,indoleacrylic acid van PubChem CID: 5375048 IUPAC Name: (E)-3-(1H-indol-3-yl)prop-2-enoic acid SMILES: C1=CC=C2C(=C1)C(=CN2)C=CC(=O)O

PubChem CID 5375048
CAS 29953-71-7
Molecular Weight (g/mol) 187.198
MDL Number MFCD00005633
SMILES C1=CC=C2C(=C1)C(=CN2)C=CC(=O)O
Synonym 3-indoleacrylic acid,trans-3-indoleacrylic acid,indole-3-acrylic acid,3-indolylacrylic acid,indole-3beta-acrylic acid,3-1h-indol-3-yl acrylic acid,indole-3-crylic acid,2e-3-1h-indol-3-yl prop-2-enoic acid,trans-3-1h-indol-3-yl acrylic acid,indoleacrylic acid van
IUPAC Name (E)-3-(1H-indol-3-yl)prop-2-enoic acid
InChI Key PLVPPLCLBIEYEA-AATRIKPKSA-N
Molecular Formula C11H9NO2
12

Isopropyl acetate, 99+%

CAS: 108-21-4 Molecular Formula: C5H10O2 Molecular Weight (g/mol): 102.133 MDL Number: MFCD00008877 InChI Key: JMMWKPVZQRWMSS-UHFFFAOYSA-N Synonym: isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester PubChem CID: 7915 IUPAC Name: propan-2-yl acetate SMILES: CC(C)OC(=O)C

PubChem CID 7915
CAS 108-21-4
Molecular Weight (g/mol) 102.133
MDL Number MFCD00008877
SMILES CC(C)OC(=O)C
Synonym isopropyl acetate,2-propyl acetate,2-acetoxypropane,acetic acid, 1-methylethyl ester,isopropyl ethanoate,isopropylacetat,paracetat,isopropylacetaat,1-methylethyl acetate,acetic acid, isopropyl ester
IUPAC Name propan-2-yl acetate
InChI Key JMMWKPVZQRWMSS-UHFFFAOYSA-N
Molecular Formula C5H10O2
13

Methyl formate, 97%, may cont. up to ca 3% methanol

CAS: 107-31-3 Molecular Formula: C2H4O2 Molecular Weight (g/mol): 60.05 MDL Number: MFCD00003291 InChI Key: TZIHFWKZFHZASV-UHFFFAOYSA-N Synonym: formic acid, methyl ester,methyl methanoate,methylformiat,formic acid methyl ester,formiate de methyle,methylformiaat,mravencan methylnaty,methylformate,caswell no. 570,hcooch3 PubChem CID: 7865 ChEBI: CHEBI:77699 IUPAC Name: methyl formate SMILES: COC=O

PubChem CID 7865
CAS 107-31-3
Molecular Weight (g/mol) 60.05
ChEBI CHEBI:77699
MDL Number MFCD00003291
SMILES COC=O
Synonym formic acid, methyl ester,methyl methanoate,methylformiat,formic acid methyl ester,formiate de methyle,methylformiaat,mravencan methylnaty,methylformate,caswell no. 570,hcooch3
IUPAC Name methyl formate
InChI Key TZIHFWKZFHZASV-UHFFFAOYSA-N
Molecular Formula C2H4O2
14

Ethyl formate, 97%

CAS: 109-94-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.08 MDL Number: MFCD00003294 InChI Key: WBJINCZRORDGAQ-UHFFFAOYSA-N Synonym: areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat PubChem CID: 8025 ChEBI: CHEBI:52342 IUPAC Name: ethyl formate SMILES: CCOC=O

PubChem CID 8025
CAS 109-94-4
Molecular Weight (g/mol) 74.08
ChEBI CHEBI:52342
MDL Number MFCD00003294
SMILES CCOC=O
Synonym areginal,formic acid, ethyl ester,ethyl methanoate,formic acid ethyl ester,aethylformiat,ethyl formic ester,ethylformate,ethylformiaat,formic ether,ethylformiat
IUPAC Name ethyl formate
InChI Key WBJINCZRORDGAQ-UHFFFAOYSA-N
Molecular Formula C3H6O2
15

1-Naphthyl acetate, 99%

CAS: 830-81-9 Molecular Formula: C12H10O2 Molecular Weight (g/mol): 186.21 MDL Number: MFCD00003922 InChI Key: VGKONPUVOVVNSU-UHFFFAOYSA-N Synonym: 1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate PubChem CID: 13247 IUPAC Name: naphthalen-1-yl acetate SMILES: CC(=O)OC1=CC=CC2=CC=CC=C21

PubChem CID 13247
CAS 830-81-9
Molecular Weight (g/mol) 186.21
MDL Number MFCD00003922
SMILES CC(=O)OC1=CC=CC2=CC=CC=C21
Synonym 1-naphthyl acetate,1-acetoxynaphthalene,alpha-naphthyl acetate,1-naphthol, acetate,a-naphthyl acetate,naphthyl acetate,naphthalene, 1-acetoxy,1-naphthalenol, acetate,acetic acid 1-naphthyl ester,alpha-naphthol acetate
IUPAC Name naphthalen-1-yl acetate
InChI Key VGKONPUVOVVNSU-UHFFFAOYSA-N
Molecular Formula C12H10O2