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.

1 – 15 of 481 results

Cholesteryl nonanoate, Thermo Scientific Chemicals

CAS: 1182-66-7 Molecular Formula: C36H62O2 Molecular Weight (g/mol): 526.89 MDL Number: MFCD00003643 InChI Key: WCLNGBQPTVENHV-MKQVXYPISA-N Synonym: cholesteryl pelargonate,cholesteryl nonanoate,cholesterol pelargonate,unii-4313o7p4xw,5-cholesten-3beta-ol 3-nonanoate,cholesterol, nonanoate,3beta-hydroxy-5-cholestene 3-nonanoate,nonanoic acid cholesterol ester,pelargonic acid cholesterol ester,cholest-5-ene-3-beta-yl nonanoate PubChem CID: 2723614 IUPAC Name: [(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoate SMILES: CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C

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Specifications

PubChem CID	2723614
CAS	1182-66-7
Molecular Weight (g/mol)	526.89
MDL Number	MFCD00003643
SMILES	CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
Synonym	cholesteryl pelargonate,cholesteryl nonanoate,cholesterol pelargonate,unii-4313o7p4xw,5-cholesten-3beta-ol 3-nonanoate,cholesterol, nonanoate,3beta-hydroxy-5-cholestene 3-nonanoate,nonanoic acid cholesterol ester,pelargonic acid cholesterol ester,cholest-5-ene-3-beta-yl nonanoate
IUPAC Name	[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoate
InChI Key	WCLNGBQPTVENHV-MKQVXYPISA-N
Molecular Formula	C36H62O2

(-)-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

Pricing and Availability
Specifications

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

1H-Imidazole-2-carboxylic acid, 97%, Thermo Scientific™

CAS: 16042-25-4 Molecular Formula: C4H4N2O2 Molecular Weight (g/mol): 112.088 InChI Key: KYWMCFOWDYFYLV-UHFFFAOYSA-N Synonym: 2-imidazolecarboxylic acid,imidazole-2-carboxylic acid,unii-o9g6515vc1,1h-imidazolecarboxylic acid,2-imidazolecarboxylicacid,2-imidazocarboxylic acid,1h-imidazole-2-carboxylicacid,imidazolecarboxylic,acmc-1avrt,2-carboxy-1h-imidazole PubChem CID: 574321 IUPAC Name: 1H-imidazole-2-carboxylic acid SMILES: C1=CN=C(N1)C(=O)O

Pricing and Availability
Specifications

PubChem CID	574321
CAS	16042-25-4
Molecular Weight (g/mol)	112.088
SMILES	C1=CN=C(N1)C(=O)O
Synonym	2-imidazolecarboxylic acid,imidazole-2-carboxylic acid,unii-o9g6515vc1,1h-imidazolecarboxylic acid,2-imidazolecarboxylicacid,2-imidazocarboxylic acid,1h-imidazole-2-carboxylicacid,imidazolecarboxylic,acmc-1avrt,2-carboxy-1h-imidazole
IUPAC Name	1H-imidazole-2-carboxylic acid
InChI Key	KYWMCFOWDYFYLV-UHFFFAOYSA-N
Molecular Formula	C4H4N2O2

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Cholesteryl pelargonate, +99%, Thermo Scientific Chemicals

Pricing and Availability
Specifications

PubChem CID	2723614
CAS	1182-66-7
Molecular Weight (g/mol)	526.89
MDL Number	MFCD00003643
SMILES	CCCCCCCCC(=O)OC1CCC2(C3CCC4(C(C3CC=C2C1)CCC4C(C)CCCC(C)C)C)C
Synonym	cholesteryl pelargonate,cholesteryl nonanoate,cholesterol pelargonate,unii-4313o7p4xw,5-cholesten-3beta-ol 3-nonanoate,cholesterol, nonanoate,3beta-hydroxy-5-cholestene 3-nonanoate,nonanoic acid cholesterol ester,pelargonic acid cholesterol ester,cholest-5-ene-3-beta-yl nonanoate
IUPAC Name	[(3S,8S,9S,10R,13R,14S,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] nonanoate
InChI Key	WCLNGBQPTVENHV-MKQVXYPISA-N
Molecular Formula	C36H62O2

6-Quinoxalinecarboxylic acid, 95%, Thermo Scientific™

CAS: 6925-00-4 Molecular Formula: C9H6N2O2 Molecular Weight (g/mol): 174.159 InChI Key: JGQDBVXRYDEWGM-UHFFFAOYSA-N Synonym: 6-quinoxalinecarboxylic acid,chinoxalin-6-carbonsaeure,quinoxaline-6-carboxylicacid,pubchem15419,quinoxaline-6-carboxylic acid PubChem CID: 674813 IUPAC Name: quinoxaline-6-carboxylic acid SMILES: C1=CC2=NC=CN=C2C=C1C(=O)O

Pricing and Availability
Specifications

PubChem CID	674813
CAS	6925-00-4
Molecular Weight (g/mol)	174.159
SMILES	C1=CC2=NC=CN=C2C=C1C(=O)O
Synonym	6-quinoxalinecarboxylic acid,chinoxalin-6-carbonsaeure,quinoxaline-6-carboxylicacid,pubchem15419,quinoxaline-6-carboxylic acid
IUPAC Name	quinoxaline-6-carboxylic acid
InChI Key	JGQDBVXRYDEWGM-UHFFFAOYSA-N
Molecular Formula	C9H6N2O2

1-Naphthyl acetate, 99%, Thermo Scientific Chemicals

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

Pricing and Availability
Specifications

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

Ethyl 4-cyanophenylacetate, 98%, Thermo Scientific Chemicals

CAS: 1528-41-2 Molecular Formula: C11H11NO2 Molecular Weight (g/mol): 189.214 MDL Number: MFCD09953133 InChI Key: DFEWKWBIPMKGFG-UHFFFAOYSA-N Synonym: ethyl 2-4-cyanophenyl acetate,ethyl 4-cyanophenylacetate,ethyl 4-cyanophenyl acetate,4-cyano-phenyl acetic acid ethyl ester,ethyl p-cyanophenylacetate,acmc-1bve3,ethyl 4-cyanobenzeneacetate,ethyl4-cyanophenylacetate,4-cyanophenylacetic acid ethyl ester PubChem CID: 279718 IUPAC Name: ethyl 2-(4-cyanophenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)C#N

Pricing and Availability
Specifications

PubChem CID	279718
CAS	1528-41-2
Molecular Weight (g/mol)	189.214
MDL Number	MFCD09953133
SMILES	CCOC(=O)CC1=CC=C(C=C1)C#N
Synonym	ethyl 2-4-cyanophenyl acetate,ethyl 4-cyanophenylacetate,ethyl 4-cyanophenyl acetate,4-cyano-phenyl acetic acid ethyl ester,ethyl p-cyanophenylacetate,acmc-1bve3,ethyl 4-cyanobenzeneacetate,ethyl4-cyanophenylacetate,4-cyanophenylacetic acid ethyl ester
IUPAC Name	ethyl 2-(4-cyanophenyl)acetate
InChI Key	DFEWKWBIPMKGFG-UHFFFAOYSA-N
Molecular Formula	C11H11NO2

3-Cyclohexenecarboxylic acid, 97%, Thermo Scientific Chemicals

CAS: 4771-80-6 Molecular Formula: C₇H₁₀O₂ Molecular Weight (g/mol): 126.15 MDL Number: MFCD00013781 InChI Key: VUSWCWPCANWBFG-UHFFFAOYSA-N Synonym: 3-cyclohexene-1-carboxylic acid,3-cyclohexenecarboxylic acid,cyclohex-3-enecarboxylic acid,1,2,3,6-tetrahydrobenzoic acid,1-cyclohexene-4-carboxylic acid,delta3-cyclohexenylcarboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova,3-cyclohexene carboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova czech,.delta.3-cyclohexenecarboxylic acid PubChem CID: 20903 IUPAC Name: cyclohex-3-ene-1-carboxylic acid SMILES: C1CC(CC=C1)C(=O)O

Pricing and Availability
Specifications

PubChem CID	20903
CAS	4771-80-6
Molecular Weight (g/mol)	126.15
MDL Number	MFCD00013781
SMILES	C1CC(CC=C1)C(=O)O
Synonym	3-cyclohexene-1-carboxylic acid,3-cyclohexenecarboxylic acid,cyclohex-3-enecarboxylic acid,1,2,3,6-tetrahydrobenzoic acid,1-cyclohexene-4-carboxylic acid,delta3-cyclohexenylcarboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova,3-cyclohexene carboxylic acid,kyselina 1,2,5,6-tetrahydrobenzoova czech,.delta.3-cyclohexenecarboxylic acid
IUPAC Name	cyclohex-3-ene-1-carboxylic acid
InChI Key	VUSWCWPCANWBFG-UHFFFAOYSA-N
Molecular Formula	C₇H₁₀O₂

1-Phenylcyclopentanecarboxylic acid, 98%, Thermo Scientific™

CAS: 77-55-4 Molecular Formula: C12H14O2 Molecular Weight (g/mol): 190.24 MDL Number: MFCD00001372 InChI Key: RHPCYZLXNNRRMB-UHFFFAOYSA-N Synonym: 1-phenylcyclopentanecarboxylic acid,1-phenyl-1-cyclopentanecarboxylic acid,cyclopentanecarboxylic acid, 1-phenyl,1-phenyl-cyclopentanecarboxylic acid,1-phenylcyclopentane carboxylic acid,cyclopentanecarboxylicacid, 1-phenyl,pubchem22923,acmc-209pao,phenylcyclopentanecarboxylic acid,phenylcyclopentane carboxylic acid PubChem CID: 66167 IUPAC Name: 1-phenylcyclopentane-1-carboxylic acid SMILES: OC(=O)C1(CCCC1)C1=CC=CC=C1

Pricing and Availability
Specifications

PubChem CID	66167
CAS	77-55-4
Molecular Weight (g/mol)	190.24
MDL Number	MFCD00001372
SMILES	OC(=O)C1(CCCC1)C1=CC=CC=C1
Synonym	1-phenylcyclopentanecarboxylic acid,1-phenyl-1-cyclopentanecarboxylic acid,cyclopentanecarboxylic acid, 1-phenyl,1-phenyl-cyclopentanecarboxylic acid,1-phenylcyclopentane carboxylic acid,cyclopentanecarboxylicacid, 1-phenyl,pubchem22923,acmc-209pao,phenylcyclopentanecarboxylic acid,phenylcyclopentane carboxylic acid
IUPAC Name	1-phenylcyclopentane-1-carboxylic acid
InChI Key	RHPCYZLXNNRRMB-UHFFFAOYSA-N
Molecular Formula	C12H14O2

3-Methylbut-2-enyl formate, Thermo Scientific™

CAS: 68480-28-4 Molecular Formula: C6H10O2 Molecular Weight (g/mol): 114.14 MDL Number: MFCD00036614 InChI Key: ZCROFVOAWLRGFY-UHFFFAOYSA-N Synonym: prenyl formate,2-buten-1-ol, 3-methyl-, formate,unii-77xfk1mol6,2-buten-1-ol, 3-methyl-, 1-formate,3-methylbut-2-en-1-yl formate,77xfk1mol6,formic acid, 3-methyl-2-butenyl ester,prenylformiat,3-methyl but-2-enyl formate,3-methyl-2-butenyl formate # PubChem CID: 110373 SMILES: CC(C)=CCOC=O

Pricing and Availability
Specifications

PubChem CID	110373
CAS	68480-28-4
Molecular Weight (g/mol)	114.14
MDL Number	MFCD00036614
SMILES	CC(C)=CCOC=O
Synonym	prenyl formate,2-buten-1-ol, 3-methyl-, formate,unii-77xfk1mol6,2-buten-1-ol, 3-methyl-, 1-formate,3-methylbut-2-en-1-yl formate,77xfk1mol6,formic acid, 3-methyl-2-butenyl ester,prenylformiat,3-methyl but-2-enyl formate,3-methyl-2-butenyl formate #
InChI Key	ZCROFVOAWLRGFY-UHFFFAOYSA-N
Molecular Formula	C6H10O2

1H-indazole-3-carboxylic acid, Thermo Scientific™

CAS: 4498-67-3 Molecular Formula: C8H6N2O2 Molecular Weight (g/mol): 162.148 InChI Key: BHXVYTQDWMQVBI-UHFFFAOYSA-N Synonym: indazole-3-carboxylic acid,3-carboxyindazole,3-indazolecarboxylic acid,indazole-3-carboxylicacid,1h-indazol-3-carbonic acid,2h-indazole-3-carboxylic acid,3-carboxy-1h-indazole,1h-indazole-3-carbonic acid,1-h-indazole-3-carboxylic acid,benzopyrazole-3-carboxylic acid PubChem CID: 78250 IUPAC Name: 1H-indazole-3-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=NN2)C(=O)O

Pricing and Availability
Specifications

PubChem CID	78250
CAS	4498-67-3
Molecular Weight (g/mol)	162.148
SMILES	C1=CC=C2C(=C1)C(=NN2)C(=O)O
Synonym	indazole-3-carboxylic acid,3-carboxyindazole,3-indazolecarboxylic acid,indazole-3-carboxylicacid,1h-indazol-3-carbonic acid,2h-indazole-3-carboxylic acid,3-carboxy-1h-indazole,1h-indazole-3-carbonic acid,1-h-indazole-3-carboxylic acid,benzopyrazole-3-carboxylic acid
IUPAC Name	1H-indazole-3-carboxylic acid
InChI Key	BHXVYTQDWMQVBI-UHFFFAOYSA-N
Molecular Formula	C8H6N2O2

Quinoxaline-5-carboxylic acid, 95%, Thermo Scientific Chemicals

CAS: 6924-66-9 Molecular Formula: C₉H₆N₂O₂ Molecular Weight (g/mol): 174.16 MDL Number: MFCD02854494 InChI Key: QLZNISOPACYKOR-UHFFFAOYSA-N Synonym: 5-quinoxalinecarboxylic acid,5-carboxyquinoxaline,5-quinoxalinecarboxylicacid PubChem CID: 776833 IUPAC Name: quinoxaline-5-carboxylic acid SMILES: C1=CC(=C2C(=C1)N=CC=N2)C(=O)O

Pricing and Availability
Specifications

PubChem CID	776833
CAS	6924-66-9
Molecular Weight (g/mol)	174.16
MDL Number	MFCD02854494
SMILES	C1=CC(=C2C(=C1)N=CC=N2)C(=O)O
Synonym	5-quinoxalinecarboxylic acid,5-carboxyquinoxaline,5-quinoxalinecarboxylicacid
IUPAC Name	quinoxaline-5-carboxylic acid
InChI Key	QLZNISOPACYKOR-UHFFFAOYSA-N
Molecular Formula	C₉H₆N₂O₂

1H-Indole-2-carboxylic acid, 97%, Thermo Scientific™

CAS: 1477-50-5 Molecular Formula: C9H7NO2 Molecular Weight (g/mol): 161.16 MDL Number: MFCD00005611 InChI Key: HCUARRIEZVDMPT-UHFFFAOYSA-N Synonym: indole-2-carboxylic acid,2-carboxyindole,2-indolecarboxylic acid,indol-2-carboxylic acid,1h-indolecarboxylic acid,indole-2-carboxylate,2-indolylformic acid,2-indole carboxylic acid,1h-indol-2-carbons,carboxyindole PubChem CID: 72899 IUPAC Name: 1H-indole-2-carboxylic acid SMILES: OC(=O)C1=CC2=CC=CC=C2N1

Pricing and Availability
Specifications

PubChem CID	72899
CAS	1477-50-5
Molecular Weight (g/mol)	161.16
MDL Number	MFCD00005611
SMILES	OC(=O)C1=CC2=CC=CC=C2N1
Synonym	indole-2-carboxylic acid,2-carboxyindole,2-indolecarboxylic acid,indol-2-carboxylic acid,1h-indolecarboxylic acid,indole-2-carboxylate,2-indolylformic acid,2-indole carboxylic acid,1h-indol-2-carbons,carboxyindole
IUPAC Name	1H-indole-2-carboxylic acid
InChI Key	HCUARRIEZVDMPT-UHFFFAOYSA-N
Molecular Formula	C9H7NO2

Ethyl 5,5-dimethyl-2,4-dioxohexanoate, 97%, Thermo Scientific™

CAS: 13395-36-3 Molecular Formula: C10H16O4 Molecular Weight (g/mol): 200.234 InChI Key: NIMKIMUBJFWPTD-UHFFFAOYSA-N Synonym: ethyl trimethylacetopyruvate,hexanoic acid, 5,5-dimethyl-2,4-dioxo-, ethyl ester,5,5-dimethyl-2,4-dioxo-hexanoic acid ethyl ester,5,5-dimethyl-2,4-dioxohexanoic acid ethyl ester,ethyl pivaloylpyruvate,pivaloylpyruvic acid ethyl ester,3-pivaloylpyruvic acid ethyl ester,ethyl5,5-dimethyl-2,4-dioxohexanoate,trimethylacetopyruvic acid ethyl ester,ethyl 5,5-dimethyl-2,4-dioxo-hexanoate PubChem CID: 83403 IUPAC Name: ethyl 5,5-dimethyl-2,4-dioxohexanoate SMILES: CCOC(=O)C(=O)CC(=O)C(C)(C)C

Pricing and Availability
Specifications

PubChem CID	83403
CAS	13395-36-3
Molecular Weight (g/mol)	200.234
SMILES	CCOC(=O)C(=O)CC(=O)C(C)(C)C
Synonym	ethyl trimethylacetopyruvate,hexanoic acid, 5,5-dimethyl-2,4-dioxo-, ethyl ester,5,5-dimethyl-2,4-dioxo-hexanoic acid ethyl ester,5,5-dimethyl-2,4-dioxohexanoic acid ethyl ester,ethyl pivaloylpyruvate,pivaloylpyruvic acid ethyl ester,3-pivaloylpyruvic acid ethyl ester,ethyl5,5-dimethyl-2,4-dioxohexanoate,trimethylacetopyruvic acid ethyl ester,ethyl 5,5-dimethyl-2,4-dioxo-hexanoate
IUPAC Name	ethyl 5,5-dimethyl-2,4-dioxohexanoate
InChI Key	NIMKIMUBJFWPTD-UHFFFAOYSA-N
Molecular Formula	C10H16O4

1-Benzothiophene-7-carboxylic acid, 97%, Thermo Scientific™

CAS: 10134-98-2 Molecular Formula: C9H6O2S Molecular Weight (g/mol): 178.205 InChI Key: LJPSRTWIAXVPIS-UHFFFAOYSA-N Synonym: benzo b thiophene-7-carboxylic acid,benzo b thiophene-7-carboxylicacid,7-carboxybenzo b thiophene,1-benzo b thiophene-7-carboxylic acid PubChem CID: 14235073 IUPAC Name: 1-benzothiophene-7-carboxylic acid SMILES: C1=CC2=C(C(=C1)C(=O)O)SC=C2

Pricing and Availability
Specifications

PubChem CID	14235073
CAS	10134-98-2
Molecular Weight (g/mol)	178.205
SMILES	C1=CC2=C(C(=C1)C(=O)O)SC=C2
Synonym	benzo b thiophene-7-carboxylic acid,benzo b thiophene-7-carboxylicacid,7-carboxybenzo b thiophene,1-benzo b thiophene-7-carboxylic acid
IUPAC Name	1-benzothiophene-7-carboxylic acid
InChI Key	LJPSRTWIAXVPIS-UHFFFAOYSA-N
Molecular Formula	C9H6O2S

Monocarboxylic acids and derivatives

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