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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601 – 615 of 2,326 results

601

2-Ethylhexyl Cyanoacetate 98.0+%, TCI America™

CAS: 13361-34-7 Molecular Formula: C11H19NO2 Molecular Weight (g/mol): 197.28 MDL Number: MFCD00019843 InChI Key: ZNYBQVBNSXLZNI-UHFFFAOYNA-N Synonym: 2-ethylhexyl cyanoacetate,acetic acid, cyano-, 2-ethylhexyl ester,cyanoacetic acid, 2-ethylhexyl ester,2-ethylhexylcyanoacetate,cyanoacetic acid octyl ester,acetic acid, 2-cyano-, 2-ethylhexyl ester,cyanoacetic acid 2-ethylhexyl ester,ehca,thcn-nva,acmc-209bt2 PubChem CID: 96359 IUPAC Name: 2-ethylhexyl 2-cyanoacetate SMILES: CCCCC(CC)COC(=O)CC#N

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PubChem CID	96359
CAS	13361-34-7
Molecular Weight (g/mol)	197.28
MDL Number	MFCD00019843
SMILES	CCCCC(CC)COC(=O)CC#N
Synonym	2-ethylhexyl cyanoacetate,acetic acid, cyano-, 2-ethylhexyl ester,cyanoacetic acid, 2-ethylhexyl ester,2-ethylhexylcyanoacetate,cyanoacetic acid octyl ester,acetic acid, 2-cyano-, 2-ethylhexyl ester,cyanoacetic acid 2-ethylhexyl ester,ehca,thcn-nva,acmc-209bt2
IUPAC Name	2-ethylhexyl 2-cyanoacetate
InChI Key	ZNYBQVBNSXLZNI-UHFFFAOYNA-N
Molecular Formula	C11H19NO2

602

Levulinic Acid 97.0+%, TCI America™

CAS: 123-76-2 Molecular Formula: C5H8O3 Molecular Weight (g/mol): 116.116 MDL Number: MFCD00002796 InChI Key: JOOXCMJARBKPKM-UHFFFAOYSA-N Synonym: levulinic acid,laevulinic acid,pentanoic acid, 4-oxo,levulic acid,4-oxovaleric acid,3-acetylpropionic acid,4-ketovaleric acid,leva,gamma-ketovaleric acid,acetopropionic acid PubChem CID: 11579 ChEBI: CHEBI:45630 IUPAC Name: 4-oxopentanoic acid SMILES: CC(=O)CCC(=O)O

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Specifications

PubChem CID	11579
CAS	123-76-2
Molecular Weight (g/mol)	116.116
ChEBI	CHEBI:45630
MDL Number	MFCD00002796
SMILES	CC(=O)CCC(=O)O
Synonym	levulinic acid,laevulinic acid,pentanoic acid, 4-oxo,levulic acid,4-oxovaleric acid,3-acetylpropionic acid,4-ketovaleric acid,leva,gamma-ketovaleric acid,acetopropionic acid
IUPAC Name	4-oxopentanoic acid
InChI Key	JOOXCMJARBKPKM-UHFFFAOYSA-N
Molecular Formula	C5H8O3

603

Isoamyl Propionate 98.0+%, TCI America™

CAS: 105-68-0 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00048611 InChI Key: XAOGXQMKWQFZEM-UHFFFAOYSA-N Synonym: isoamyl propionate,isoamyl propanoate,isopentyl propanoate,3-methylbutyl propionate,isopentyl propionate,isopentyl alcohol, propionate,1-butanol, 3-methyl-, propanoate,iso-pentyl propionate,propionic acid, isopentyl ester,3-methyl-1-butyl propanoate PubChem CID: 7772 ChEBI: CHEBI:87419 IUPAC Name: 3-methylbutyl propanoate SMILES: CCC(=O)OCCC(C)C

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Specifications

PubChem CID	7772
CAS	105-68-0
Molecular Weight (g/mol)	144.214
ChEBI	CHEBI:87419
MDL Number	MFCD00048611
SMILES	CCC(=O)OCCC(C)C
Synonym	isoamyl propionate,isoamyl propanoate,isopentyl propanoate,3-methylbutyl propionate,isopentyl propionate,isopentyl alcohol, propionate,1-butanol, 3-methyl-, propanoate,iso-pentyl propionate,propionic acid, isopentyl ester,3-methyl-1-butyl propanoate
IUPAC Name	3-methylbutyl propanoate
InChI Key	XAOGXQMKWQFZEM-UHFFFAOYSA-N
Molecular Formula	C8H16O2

604

Ethyl Hexanoate 99.0+%, TCI America™

CAS: 123-66-0 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.214 MDL Number: MFCD00009511 InChI Key: SHZIWNPUGXLXDT-UHFFFAOYSA-N Synonym: ethyl caproate,ethyl hexoate,hexanoic acid, ethyl ester,hexanoic acid ethyl ester,capronic ether absolute,caproic acid ethyl ester,ethyl n-hexanoate,ethyl butyl acetate,caproate,acetic acid, butyl-, ethyl ester PubChem CID: 31265 ChEBI: CHEBI:86055 IUPAC Name: ethyl hexanoate SMILES: CCCCCC(=O)OCC

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Specifications

PubChem CID	31265
CAS	123-66-0
Molecular Weight (g/mol)	144.214
ChEBI	CHEBI:86055
MDL Number	MFCD00009511
SMILES	CCCCCC(=O)OCC
Synonym	ethyl caproate,ethyl hexoate,hexanoic acid, ethyl ester,hexanoic acid ethyl ester,capronic ether absolute,caproic acid ethyl ester,ethyl n-hexanoate,ethyl butyl acetate,caproate,acetic acid, butyl-, ethyl ester
IUPAC Name	ethyl hexanoate
InChI Key	SHZIWNPUGXLXDT-UHFFFAOYSA-N
Molecular Formula	C8H16O2

605

1-Methylindazole-3-carboxylic Acid 98.0+%, TCI America™

CAS: 50890-83-0 Molecular Formula: C9H8N2O2 Molecular Weight (g/mol): 176.175 MDL Number: MFCD00272569 InChI Key: OVVDFORZEGKEJM-UHFFFAOYSA-N Synonym: 1-methyl-1h-indazole-3-carboxylic acid,n-methyl-indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylic acid,1h-indazole-3-carboxylic acid, 1-methyl,1-methyl-indazole-3-carboxylic acid,n-methylindazole-3-carboxylic acid,1-methylindozole-3-carboxylic acid,n-methyl-indozole-3-carboxylic acid,n-methyl-1h indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylicacid PubChem CID: 689105 IUPAC Name: 1-methylindazole-3-carboxylic acid SMILES: CN1C2=CC=CC=C2C(=N1)C(=O)O

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Specifications

PubChem CID	689105
CAS	50890-83-0
Molecular Weight (g/mol)	176.175
MDL Number	MFCD00272569
SMILES	CN1C2=CC=CC=C2C(=N1)C(=O)O
Synonym	1-methyl-1h-indazole-3-carboxylic acid,n-methyl-indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylic acid,1h-indazole-3-carboxylic acid, 1-methyl,1-methyl-indazole-3-carboxylic acid,n-methylindazole-3-carboxylic acid,1-methylindozole-3-carboxylic acid,n-methyl-indozole-3-carboxylic acid,n-methyl-1h indazole-3-carboxylic acid,1-methyl-3-indazolecarboxylicacid
IUPAC Name	1-methylindazole-3-carboxylic acid
InChI Key	OVVDFORZEGKEJM-UHFFFAOYSA-N
Molecular Formula	C9H8N2O2

606

Hexyl Propionate 98.0+%, TCI America™

CAS: 2445-76-3 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.241 MDL Number: MFCD00085197 InChI Key: GOKKOFHHJFGZHW-UHFFFAOYSA-N Synonym: Propionic Acid Hexyl Ester PubChem CID: 88454 ChEBI: CHEBI:87549 IUPAC Name: hexyl propanoate SMILES: CCCCCCOC(=O)CC

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Specifications

PubChem CID	88454
CAS	2445-76-3
Molecular Weight (g/mol)	158.241
ChEBI	CHEBI:87549
MDL Number	MFCD00085197
SMILES	CCCCCCOC(=O)CC
Synonym	Propionic Acid Hexyl Ester
IUPAC Name	hexyl propanoate
InChI Key	GOKKOFHHJFGZHW-UHFFFAOYSA-N
Molecular Formula	C9H18O2

607

Ethyl 3-Phenylpropionate 98.0+%, TCI America™

CAS: 2021-28-5 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00009206 InChI Key: JAGZUIGGHGTFHO-UHFFFAOYSA-N Synonym: ethyl 3-phenylpropionate,ethyl hydrocinnamate,ethyl dihydrocinnamate,benzenepropanoic acid, ethyl ester,3-phenylpropionic acid ethyl ester,hydrocinnamic acid, ethyl ester,ethylhydrocinnamoate,ethyl benzenepropanoate,unii-58e9z9v64d,ethylphenyl propanoate PubChem CID: 16237 IUPAC Name: ethyl 3-phenylpropanoate SMILES: CCOC(=O)CCC1=CC=CC=C1

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Specifications

PubChem CID	16237
CAS	2021-28-5
Molecular Weight (g/mol)	178.231
MDL Number	MFCD00009206
SMILES	CCOC(=O)CCC1=CC=CC=C1
Synonym	ethyl 3-phenylpropionate,ethyl hydrocinnamate,ethyl dihydrocinnamate,benzenepropanoic acid, ethyl ester,3-phenylpropionic acid ethyl ester,hydrocinnamic acid, ethyl ester,ethylhydrocinnamoate,ethyl benzenepropanoate,unii-58e9z9v64d,ethylphenyl propanoate
IUPAC Name	ethyl 3-phenylpropanoate
InChI Key	JAGZUIGGHGTFHO-UHFFFAOYSA-N
Molecular Formula	C11H14O2

608

Propyl Isobutyrate 97.0+%, TCI America™

CAS: 644-49-5 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00053781 InChI Key: AZFUASHXSOTBNU-UHFFFAOYSA-N Synonym: Isobutyric Acid Propyl Ester PubChem CID: 12571 IUPAC Name: propyl 2-methylpropanoate SMILES: CCCOC(=O)C(C)C

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Specifications

PubChem CID	12571
CAS	644-49-5
Molecular Weight (g/mol)	130.187
MDL Number	MFCD00053781
SMILES	CCCOC(=O)C(C)C
Synonym	Isobutyric Acid Propyl Ester
IUPAC Name	propyl 2-methylpropanoate
InChI Key	AZFUASHXSOTBNU-UHFFFAOYSA-N
Molecular Formula	C7H14O2

609

3-(4-Nitrophenyl)propionic Acid 98.0+%, TCI America™

CAS: 16642-79-8 Molecular Formula: C9H9NO4 Molecular Weight (g/mol): 195.17 MDL Number: MFCD00126834 InChI Key: VZOPVJNBOQOLPN-UHFFFAOYSA-N Synonym: 3-4-nitrophenyl propanoic acid,3-4-nitrophenyl propionic acid,benzenepropanoic acid, 4-nitro,3-4-nitrophenyl-propionic acid,4-nitrobenzenepropanoic acid,p-nitrohydrozimtsaure,pubchem13615,p-nitrohydrocinnamic acid PubChem CID: 85526 IUPAC Name: 3-(4-nitrophenyl)propanoic acid SMILES: OC(=O)CCC1=CC=C(C=C1)[N+]([O-])=O

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Specifications

PubChem CID	85526
CAS	16642-79-8
Molecular Weight (g/mol)	195.17
MDL Number	MFCD00126834
SMILES	OC(=O)CCC1=CC=C(C=C1)[N+]([O-])=O
Synonym	3-4-nitrophenyl propanoic acid,3-4-nitrophenyl propionic acid,benzenepropanoic acid, 4-nitro,3-4-nitrophenyl-propionic acid,4-nitrobenzenepropanoic acid,p-nitrohydrozimtsaure,pubchem13615,p-nitrohydrocinnamic acid
IUPAC Name	3-(4-nitrophenyl)propanoic acid
InChI Key	VZOPVJNBOQOLPN-UHFFFAOYSA-N
Molecular Formula	C9H9NO4

610

Isobutyl n-Octanoate 99.0+%, TCI America™

CAS: 5461-06-3 Molecular Formula: C12H24O2 Molecular Weight (g/mol): 200.32 MDL Number: MFCD00059444 InChI Key: CFQRBRGFNFRMBD-UHFFFAOYSA-N Synonym: n-Octanoic Acid Isobutyl Ester PubChem CID: 79582 IUPAC Name: 2-methylpropyl octanoate SMILES: CCCCCCCC(=O)OCC(C)C

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Specifications

PubChem CID	79582
CAS	5461-06-3
Molecular Weight (g/mol)	200.32
MDL Number	MFCD00059444
SMILES	CCCCCCCC(=O)OCC(C)C
Synonym	n-Octanoic Acid Isobutyl Ester
IUPAC Name	2-methylpropyl octanoate
InChI Key	CFQRBRGFNFRMBD-UHFFFAOYSA-N
Molecular Formula	C12H24O2

611

tert-Butyl 5-Norbornene-2-carboxylate (endo- and exo- mixture) 95.0+%, TCI America™

CAS: 154970-45-3 Molecular Formula: C12H18O2 Molecular Weight (g/mol): 194.274 MDL Number: MFCD18083704 InChI Key: BZBMBZJUNPMEBD-UHFFFAOYSA-N Synonym: 5-Norbornene-2-carboxylic Acid tert-Butyl Ester, tert-Butyl Bicyclo[2.2.1]hept-5-ene-2-carboxylate, Bicyclo[2.2.1]hept-5-ene-2-carboxylic Acid tert-Butyl Ester PubChem CID: 15607334 IUPAC Name: tert-butyl bicyclo[2.2.1]hept-2-ene-5-carboxylate SMILES: CC(C)(C)OC(=O)C1CC2CC1C=C2

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Specifications

PubChem CID	15607334
CAS	154970-45-3
Molecular Weight (g/mol)	194.274
MDL Number	MFCD18083704
SMILES	CC(C)(C)OC(=O)C1CC2CC1C=C2
Synonym	5-Norbornene-2-carboxylic Acid tert-Butyl Ester, tert-Butyl Bicyclo[2.2.1]hept-5-ene-2-carboxylate, Bicyclo[2.2.1]hept-5-ene-2-carboxylic Acid tert-Butyl Ester
IUPAC Name	tert-butyl bicyclo[2.2.1]hept-2-ene-5-carboxylate
InChI Key	BZBMBZJUNPMEBD-UHFFFAOYSA-N
Molecular Formula	C12H18O2

612

Isopropyl Linoleate 60.0+%, TCI America™

CAS: 22882-95-7 Molecular Formula: C21H38O2 Molecular Weight (g/mol): 322.533 MDL Number: MFCD00053809 InChI Key: XEIOPEQGDSYOIH-MVKOLZDDSA-N Synonym: Linoleic Acid Isopropyl Ester PubChem CID: 13647303 IUPAC Name: propan-2-yl (9E,12E)-octadeca-9,12-dienoate SMILES: CCCCCC=CCC=CCCCCCCCC(=O)OC(C)C

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Specifications

PubChem CID	13647303
CAS	22882-95-7
Molecular Weight (g/mol)	322.533
MDL Number	MFCD00053809
SMILES	CCCCCC=CCC=CCCCCCCCC(=O)OC(C)C
Synonym	Linoleic Acid Isopropyl Ester
IUPAC Name	propan-2-yl (9E,12E)-octadeca-9,12-dienoate
InChI Key	XEIOPEQGDSYOIH-MVKOLZDDSA-N
Molecular Formula	C21H38O2

613

Ethyl 1,3-Dimethylpyrazole-5-carboxylate 96.0+%, TCI America™

CAS: 5744-40-1 Molecular Formula: C8H12N2O2 Molecular Weight (g/mol): 168.20 MDL Number: MFCD00233452 InChI Key: ZYSGPOXVDOROJU-UHFFFAOYSA-N Synonym: ethyl 1,3-dimethyl-1h-pyrazole-5-carboxylate,ethyl 1,3-dimethylpyrazole-5-carboxylate,1,3-dimethyl-5-ethoxycarbonylpyrazole,1,3-dimethylpyrazole-5-carboxylic acid ethyl ester,2,5-dimethyl-2h-pyrazole-3-carboxylic acid ethyl ester,ethyl1,3-dimethyl-1h-pyrazole-5-carboxylate,ethyl 1,3-dimethyl-5-pyrazolecarboxylate,ethyl 2,5-dimethyl-2h-pyrazole-3-carboxylate,1h-pyrazole-5-carboxylic acid, 1,3-dimethyl-, ethyl ester,1,3-dimethyl-1h-pyrazole-5-carboxylic acid ethyl ester PubChem CID: 138576 IUPAC Name: ethyl 1,3-dimethyl-1H-pyrazole-5-carboxylate SMILES: CCOC(=O)C1=CC(C)=NN1C

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Specifications

PubChem CID	138576
CAS	5744-40-1
Molecular Weight (g/mol)	168.20
MDL Number	MFCD00233452
SMILES	CCOC(=O)C1=CC(C)=NN1C
Synonym	ethyl 1,3-dimethyl-1h-pyrazole-5-carboxylate,ethyl 1,3-dimethylpyrazole-5-carboxylate,1,3-dimethyl-5-ethoxycarbonylpyrazole,1,3-dimethylpyrazole-5-carboxylic acid ethyl ester,2,5-dimethyl-2h-pyrazole-3-carboxylic acid ethyl ester,ethyl1,3-dimethyl-1h-pyrazole-5-carboxylate,ethyl 1,3-dimethyl-5-pyrazolecarboxylate,ethyl 2,5-dimethyl-2h-pyrazole-3-carboxylate,1h-pyrazole-5-carboxylic acid, 1,3-dimethyl-, ethyl ester,1,3-dimethyl-1h-pyrazole-5-carboxylic acid ethyl ester
IUPAC Name	ethyl 1,3-dimethyl-1H-pyrazole-5-carboxylate
InChI Key	ZYSGPOXVDOROJU-UHFFFAOYSA-N
Molecular Formula	C8H12N2O2

614

Ethyl Pyrrole-2-carboxylate 98.0+%, TCI America™

CAS: 2199-43-1 Molecular Formula: C7H9NO2 Molecular Weight (g/mol): 139.154 MDL Number: MFCD00817049 InChI Key: PAEYAKGINDQUCT-UHFFFAOYSA-N Synonym: ethyl pyrrole-2-carboxylate,ethyl 2-pyrrolecarboxylate,ethyl pyrrole-2-carbonate,ethylpyrrole-2-carboxylate,1h-pyrrole-2-carboxylic acid, ethyl ester,2-ethoxycarbonyl-1h-pyrrole,pyrrole-2-carboxylic acid, ethyl ester,1h-pyrrole-2-carboxylic acid ethyl ester,pyrrole-2-carboxylic acid ethyl ester,ethyl1h-pyrrole-2-carboxylate PubChem CID: 255670 IUPAC Name: ethyl 1H-pyrrole-2-carboxylate SMILES: CCOC(=O)C1=CC=CN1

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Specifications

PubChem CID	255670
CAS	2199-43-1
Molecular Weight (g/mol)	139.154
MDL Number	MFCD00817049
SMILES	CCOC(=O)C1=CC=CN1
Synonym	ethyl pyrrole-2-carboxylate,ethyl 2-pyrrolecarboxylate,ethyl pyrrole-2-carbonate,ethylpyrrole-2-carboxylate,1h-pyrrole-2-carboxylic acid, ethyl ester,2-ethoxycarbonyl-1h-pyrrole,pyrrole-2-carboxylic acid, ethyl ester,1h-pyrrole-2-carboxylic acid ethyl ester,pyrrole-2-carboxylic acid ethyl ester,ethyl1h-pyrrole-2-carboxylate
IUPAC Name	ethyl 1H-pyrrole-2-carboxylate
InChI Key	PAEYAKGINDQUCT-UHFFFAOYSA-N
Molecular Formula	C7H9NO2

615

Propyl Butyrate 98.0+%, TCI America™

CAS: 105-66-8 Molecular Formula: C7H14O2 Molecular Weight (g/mol): 130.187 MDL Number: MFCD00009396 InChI Key: HUAZGNHGCJGYNP-UHFFFAOYSA-N Synonym: propyl butyrate,butanoic acid, propyl ester,propyl n-butyrate,butyric acid, propyl ester,1-propyl butyrate,n-propyl butyrate,n-propyl n-butyrate,n-propyl-n-butanoate,n-butyric acid n-propyl ester,butyric acid propyl ester PubChem CID: 7770 IUPAC Name: propyl butanoate SMILES: CCCC(=O)OCCC

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Specifications

PubChem CID	7770
CAS	105-66-8
Molecular Weight (g/mol)	130.187
MDL Number	MFCD00009396
SMILES	CCCC(=O)OCCC
Synonym	propyl butyrate,butanoic acid, propyl ester,propyl n-butyrate,butyric acid, propyl ester,1-propyl butyrate,n-propyl butyrate,n-propyl n-butyrate,n-propyl-n-butanoate,n-butyric acid n-propyl ester,butyric acid propyl ester
IUPAC Name	propyl butanoate
InChI Key	HUAZGNHGCJGYNP-UHFFFAOYSA-N
Molecular Formula	C7H14O2

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