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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Propionic Acid (Certified ACS), Fisher Chemical

CAS: 79-09-4 Molecular Formula: C3H6O2 Molecular Weight (g/mol): 74.079 MDL Number: MFCD00002756 InChI Key: XBDQKXXYIPTUBI-UHFFFAOYSA-N Synonym: propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin PubChem CID: 1032 ChEBI: CHEBI:30768 IUPAC Name: propanoic acid SMILES: CCC(=O)O

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PubChem CID	1032
CAS	79-09-4
Molecular Weight (g/mol)	74.079
ChEBI	CHEBI:30768
MDL Number	MFCD00002756
SMILES	CCC(=O)O
Synonym	propionic acid,ethylformic acid,methylacetic acid,carboxyethane,ethanecarboxylic acid,pseudoacetic acid,metacetonic acid,monoprop,luprosil,prozoin
IUPAC Name	propanoic acid
InChI Key	XBDQKXXYIPTUBI-UHFFFAOYSA-N
Molecular Formula	C3H6O2

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n-Butyl Acetate (Reagent), Fisher Chemical™

CAS: 123-86-4 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009445 InChI Key: DKPFZGUDAPQIHT-UHFFFAOYSA-N Synonym: n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle PubChem CID: 31272 ChEBI: CHEBI:31328 IUPAC Name: butyl acetate SMILES: CCCCOC(C)=O

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Specifications

PubChem CID	31272
CAS	123-86-4
Molecular Weight (g/mol)	116.16
ChEBI	CHEBI:31328
MDL Number	MFCD00009445
SMILES	CCCCOC(C)=O
Synonym	n-butyl acetate,acetic acid, butyl ester,1-butyl acetate,butyl ethanoate,acetic acid butyl ester,n-butyl ethanoate,n-butylacetate,butylacetat,acetic acid n-butyl ester,acetate de butyle
IUPAC Name	butyl acetate
InChI Key	DKPFZGUDAPQIHT-UHFFFAOYSA-N
Molecular Formula	C6H12O2

Cesium acetate, 97%, pure

CAS: 3396-11-0 Molecular Formula: C₂H₃CsO₂ Molecular Weight (g/mol): 191.96 MDL Number: MFCD00013056 InChI Key: ZOAIGCHJWKDIPJ-UHFFFAOYSA-M Synonym: cesium acetate,acetic acid, cesium salt,caesium acetate,acetic acid, cesium salt 1:1,acetic acid, cesiumsalt,acetic acid cesium salt,caesium 1+ ion acetate,cesiumacetate,acetic acid cesium,caesium 1+ acetate ion PubChem CID: 5152919 IUPAC Name: cesium;acetate SMILES: CC(=O)[O-].[Cs+]

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Specifications

PubChem CID	5152919
CAS	3396-11-0
Molecular Weight (g/mol)	191.96
MDL Number	MFCD00013056
SMILES	CC(=O)[O-].[Cs+]
Synonym	cesium acetate,acetic acid, cesium salt,caesium acetate,acetic acid, cesium salt 1:1,acetic acid, cesiumsalt,acetic acid cesium salt,caesium 1+ ion acetate,cesiumacetate,acetic acid cesium,caesium 1+ acetate ion
IUPAC Name	cesium;acetate
InChI Key	ZOAIGCHJWKDIPJ-UHFFFAOYSA-M
Molecular Formula	C₂H₃CsO₂

3-Methyl-1H-pyrazole-5-carboxylic acid, 97%

CAS: 402-61-9 Molecular Formula: C5H6N2O2 Molecular Weight (g/mol): 126.115 MDL Number: MFCD00462235 InChI Key: WSMQKESQZFQMFW-UHFFFAOYSA-N Synonym: 3-methyl-1h-pyrazole-5-carboxylic acid,5-methylpyrazole-3-carboxylic acid,5-methyl-2h-pyrazole-3-carboxylic acid,3-methylpyrazole-5-carboxylic acid,1h-pyrazole-3-carboxylicacid, 5-methyl,5-methylpyrazole-3-carboxylicacid,3-methyl-1h-pyrazole-5-carboxylicacid,pyrazole-3-carboxylic acid, 5-methyl,pubchem7842,5-methyl-2h-pyrazole-3-carboxylicacid PubChem CID: 9822 ChEBI: CHEBI:74739 IUPAC Name: 5-methyl-1H-pyrazole-3-carboxylic acid SMILES: CC1=CC(=NN1)C(=O)O

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Specifications

PubChem CID	9822
CAS	402-61-9
Molecular Weight (g/mol)	126.115
ChEBI	CHEBI:74739
MDL Number	MFCD00462235
SMILES	CC1=CC(=NN1)C(=O)O
Synonym	3-methyl-1h-pyrazole-5-carboxylic acid,5-methylpyrazole-3-carboxylic acid,5-methyl-2h-pyrazole-3-carboxylic acid,3-methylpyrazole-5-carboxylic acid,1h-pyrazole-3-carboxylicacid, 5-methyl,5-methylpyrazole-3-carboxylicacid,3-methyl-1h-pyrazole-5-carboxylicacid,pyrazole-3-carboxylic acid, 5-methyl,pubchem7842,5-methyl-2h-pyrazole-3-carboxylicacid
IUPAC Name	5-methyl-1H-pyrazole-3-carboxylic acid
InChI Key	WSMQKESQZFQMFW-UHFFFAOYSA-N
Molecular Formula	C5H6N2O2

Manganese(II) acetate, anhydrous, 98+%

CAS: 638-38-0 Molecular Formula: C4H6MnO4 Molecular Weight (g/mol): 173.03 MDL Number: MFCD00013039 InChI Key: UOGMEBQRZBEZQT-UHFFFAOYSA-L Synonym: manganese ii acetate,manganese acetate,manganous acetate,diacetylmanganese,manganese diacetate,manganese di acetate,manganese 2+ acetate,octan manganaty czech,acetic acid, manganese 2+ salt,unii-0v6e9q2i0y PubChem CID: 12525 IUPAC Name: manganese(2+);diacetate SMILES: [Mn++].CC([O-])=O.CC([O-])=O

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Specifications

PubChem CID	12525
CAS	638-38-0
Molecular Weight (g/mol)	173.03
MDL Number	MFCD00013039
SMILES	[Mn++].CC([O-])=O.CC([O-])=O
Synonym	manganese ii acetate,manganese acetate,manganous acetate,diacetylmanganese,manganese diacetate,manganese di acetate,manganese 2+ acetate,octan manganaty czech,acetic acid, manganese 2+ salt,unii-0v6e9q2i0y
IUPAC Name	manganese(2+);diacetate
InChI Key	UOGMEBQRZBEZQT-UHFFFAOYSA-L
Molecular Formula	C4H6MnO4

3-Pyridinepropionic acid, 97%

CAS: 3724-19-4 Molecular Formula: C₈H₉NO₂ Molecular Weight (g/mol): 151.16 MDL Number: MFCD00274197 InChI Key: WDGXIUUWINKTGP-UHFFFAOYSA-N Synonym: 3-3-pyridyl propionic acid,3-pyridinepropionic acid,3-pyridinepropanoic acid,3-pyridin-3-yl propanoic acid,3-3-pyridyl propionicacid,pyridine-3-propionic acid,3-3-pyridyl propanoic acid,3-pyridin-3-yl propionic acid,pubchem8701,maybridge4_001332 PubChem CID: 259624 IUPAC Name: 3-pyridin-3-ylpropanoic acid SMILES: C1=CC(=CN=C1)CCC(=O)O

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Specifications

PubChem CID	259624
CAS	3724-19-4
Molecular Weight (g/mol)	151.16
MDL Number	MFCD00274197
SMILES	C1=CC(=CN=C1)CCC(=O)O
Synonym	3-3-pyridyl propionic acid,3-pyridinepropionic acid,3-pyridinepropanoic acid,3-pyridin-3-yl propanoic acid,3-3-pyridyl propionicacid,pyridine-3-propionic acid,3-3-pyridyl propanoic acid,3-pyridin-3-yl propionic acid,pubchem8701,maybridge4_001332
IUPAC Name	3-pyridin-3-ylpropanoic acid
InChI Key	WDGXIUUWINKTGP-UHFFFAOYSA-N
Molecular Formula	C₈H₉NO₂

4-Pyridazinecarboxylic acid, 95%

CAS: 50681-25-9 Molecular Formula: C₅H₄N₂O₂ Molecular Weight (g/mol): 124.1 InChI Key: JUSIWJONLKBPDU-UHFFFAOYSA-N Synonym: 4-pyridazinecarboxylic acid,4-carboxypyridazine,4-pyridazinecarboxylicacid,pubchem9501,acmc-1alr8,pyridazin-4-carboxylic acid,4-pyridazine-carboxylic acid,ksc269i2f,pyridazin-4-yl formate,1,2-diazine-4-carboxylic acid PubChem CID: 2761046 IUPAC Name: pyridazine-4-carboxylic acid SMILES: C1=CN=NC=C1C(=O)O

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Specifications

PubChem CID	2761046
CAS	50681-25-9
Molecular Weight (g/mol)	124.1
SMILES	C1=CN=NC=C1C(=O)O
Synonym	4-pyridazinecarboxylic acid,4-carboxypyridazine,4-pyridazinecarboxylicacid,pubchem9501,acmc-1alr8,pyridazin-4-carboxylic acid,4-pyridazine-carboxylic acid,ksc269i2f,pyridazin-4-yl formate,1,2-diazine-4-carboxylic acid
IUPAC Name	pyridazine-4-carboxylic acid
InChI Key	JUSIWJONLKBPDU-UHFFFAOYSA-N
Molecular Formula	C₅H₄N₂O₂

3-Cyanophenylacetic acid, 95%

CAS: 1878-71-3 Molecular Formula: C₉H₇NO₂ Molecular Weight (g/mol): 161.16 InChI Key: ZNXMNKGBHYVNNE-UHFFFAOYSA-N PubChem CID: 1519397 IUPAC Name: 2-(3-cyanophenyl)acetic acid SMILES: C1=CC(=CC(=C1)CC(=O)O)C#N

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Specifications

PubChem CID	1519397
CAS	1878-71-3
Molecular Weight (g/mol)	161.16
SMILES	C1=CC(=CC(=C1)CC(=O)O)C#N
IUPAC Name	2-(3-cyanophenyl)acetic acid
InChI Key	ZNXMNKGBHYVNNE-UHFFFAOYSA-N
Molecular Formula	C₉H₇NO₂

Ethyl trimethylacetate, 99%

CAS: 3938-95-2 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009129 InChI Key: HHEIMYAXCOIQCJ-UHFFFAOYSA-N Synonym: ethyl trimethylacetate,ethyl pivalate,propanoic acid, 2,2-dimethyl-, ethyl ester,ethyl 2,2-dimethylpropionate,pivalic acid, ethyl ester,ethylpivalate,trimethylacetic acid, ethyl ester,unii-738s62lzwy,ethyltrimethylacetate,2,2-dimethylpropanoic acid ethyl ester PubChem CID: 19838 IUPAC Name: ethyl 2,2-dimethylpropanoate SMILES: CCOC(=O)C(C)(C)C

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Specifications

PubChem CID	19838
CAS	3938-95-2
Molecular Weight (g/mol)	130.187
MDL Number	MFCD00009129
SMILES	CCOC(=O)C(C)(C)C
Synonym	ethyl trimethylacetate,ethyl pivalate,propanoic acid, 2,2-dimethyl-, ethyl ester,ethyl 2,2-dimethylpropionate,pivalic acid, ethyl ester,ethylpivalate,trimethylacetic acid, ethyl ester,unii-738s62lzwy,ethyltrimethylacetate,2,2-dimethylpropanoic acid ethyl ester
IUPAC Name	ethyl 2,2-dimethylpropanoate
InChI Key	HHEIMYAXCOIQCJ-UHFFFAOYSA-N
Molecular Formula	C7H14O2

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

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Specifications

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

Cyclohexaneacetic acid, 98%

CAS: 5292-21-7 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00001518 InChI Key: LJOODBDWMQKMFB-UHFFFAOYSA-N Synonym: cyclohexylacetic acid,cyclohexaneacetic acid,cyclohexylethanoic acid,hexahydrophenylacetic acid,cyclohexyl acetic acid,unii-v43k3to0hn,fema no. 2347,cyclohexane-acetic acid,v43k3to0hn,cyclo-hexylacetic acid PubChem CID: 21363 ChEBI: CHEBI:37277 IUPAC Name: 2-cyclohexylacetic acid SMILES: OC(=O)CC1CCCCC1

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Specifications

PubChem CID	21363
CAS	5292-21-7
Molecular Weight (g/mol)	142.20
ChEBI	CHEBI:37277
MDL Number	MFCD00001518
SMILES	OC(=O)CC1CCCCC1
Synonym	cyclohexylacetic acid,cyclohexaneacetic acid,cyclohexylethanoic acid,hexahydrophenylacetic acid,cyclohexyl acetic acid,unii-v43k3to0hn,fema no. 2347,cyclohexane-acetic acid,v43k3to0hn,cyclo-hexylacetic acid
IUPAC Name	2-cyclohexylacetic acid
InChI Key	LJOODBDWMQKMFB-UHFFFAOYSA-N
Molecular Formula	C8H14O2

tert-Butyl pivalate, 98%

CAS: 16474-43-4 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.24 MDL Number: MFCD01861974 InChI Key: VXHFNALHLRWIIU-UHFFFAOYSA-N PubChem CID: 519272 IUPAC Name: tert-butyl 2,2-dimethylpropanoate SMILES: CC(C)(C)OC(=O)C(C)(C)C

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Specifications

PubChem CID	519272
CAS	16474-43-4
Molecular Weight (g/mol)	158.24
MDL Number	MFCD01861974
SMILES	CC(C)(C)OC(=O)C(C)(C)C
IUPAC Name	tert-butyl 2,2-dimethylpropanoate
InChI Key	VXHFNALHLRWIIU-UHFFFAOYSA-N
Molecular Formula	C9H18O2

3-(3-Bromophenyl)propionic acid, 97%

CAS: 42287-90-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD01310792 InChI Key: DWKWMFSWLCIMKI-UHFFFAOYSA-N Synonym: 3-3-bromophenyl propanoic acid,3-3-bromophenyl propionic acid,3-3-bromo-phenyl-propionic acid,3-bromophenylpropanoic acid,acmc-209jor,m-bromohydrocinnamic acid,3-bromohydrocinnamic acid,benzenepropanoic acid,3-bromo,3-3-bromophenyl propionicacid,3-m-bromophenyl propionic acid PubChem CID: 2063862 IUPAC Name: 3-(3-bromophenyl)propanoic acid SMILES: C1=CC(=CC(=C1)Br)CCC(=O)O

Pricing and Availability
Specifications

PubChem CID	2063862
CAS	42287-90-1
Molecular Weight (g/mol)	229.073
MDL Number	MFCD01310792
SMILES	C1=CC(=CC(=C1)Br)CCC(=O)O
Synonym	3-3-bromophenyl propanoic acid,3-3-bromophenyl propionic acid,3-3-bromo-phenyl-propionic acid,3-bromophenylpropanoic acid,acmc-209jor,m-bromohydrocinnamic acid,3-bromohydrocinnamic acid,benzenepropanoic acid,3-bromo,3-3-bromophenyl propionicacid,3-m-bromophenyl propionic acid
IUPAC Name	3-(3-bromophenyl)propanoic acid
InChI Key	DWKWMFSWLCIMKI-UHFFFAOYSA-N
Molecular Formula	C9H9BrO2

2,2-Dimethylbutyric acid, 97%

CAS: 595-37-9 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00004200 InChI Key: VUAXHMVRKOTJKP-UHFFFAOYSA-N Synonym: 2,2-dimethylbutyric acid,butanoic acid, 2,2-dimethyl,2,2-dimethyl-butanoic acid,2,2-dimethyl butyric acid,2,2-dimethyl butanoic acid,unii-ay606cn05o,butyric acid, 2,2-dimethyl,dimethyl ethyl acetic acid,2,2-dimethyl-butyric acid,.alpha.,.alpha.-dimethylbutyric acid PubChem CID: 11684 ChEBI: CHEBI:38649 IUPAC Name: 2,2-dimethylbutanoic acid SMILES: CCC(C)(C)C(=O)O

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Specifications

PubChem CID	11684
CAS	595-37-9
Molecular Weight (g/mol)	116.16
ChEBI	CHEBI:38649
MDL Number	MFCD00004200
SMILES	CCC(C)(C)C(=O)O
Synonym	2,2-dimethylbutyric acid,butanoic acid, 2,2-dimethyl,2,2-dimethyl-butanoic acid,2,2-dimethyl butyric acid,2,2-dimethyl butanoic acid,unii-ay606cn05o,butyric acid, 2,2-dimethyl,dimethyl ethyl acetic acid,2,2-dimethyl-butyric acid,.alpha.,.alpha.-dimethylbutyric acid
IUPAC Name	2,2-dimethylbutanoic acid
InChI Key	VUAXHMVRKOTJKP-UHFFFAOYSA-N
Molecular Formula	C6H12O2

n-Propyl propionate, 99%

CAS: 106-36-5 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00009373 InChI Key: MCSINKKTEDDPNK-UHFFFAOYSA-N Synonym: propyl propionate,n-propyl propionate,propanoic acid, propyl ester,n-propyl propanoate,propionic acid, propyl ester,n-propyl n-propionate,propylester kyseliny propionove,unii-g09trv00gk,propyl propionate natural,propionic acid n-propyl ester PubChem CID: 7803 IUPAC Name: propyl propanoate SMILES: CCCOC(=O)CC

Pricing and Availability
Specifications

PubChem CID	7803
CAS	106-36-5
Molecular Weight (g/mol)	116.16
MDL Number	MFCD00009373
SMILES	CCCOC(=O)CC
Synonym	propyl propionate,n-propyl propionate,propanoic acid, propyl ester,n-propyl propanoate,propionic acid, propyl ester,n-propyl n-propionate,propylester kyseliny propionove,unii-g09trv00gk,propyl propionate natural,propionic acid n-propyl ester
IUPAC Name	propyl propanoate
InChI Key	MCSINKKTEDDPNK-UHFFFAOYSA-N
Molecular Formula	C6H12O2

Monocarboxylic acids and derivatives

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