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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676 – 690 of 2,264 results

676

Ethyl 2-Cyanopropionate 97.0+%, TCI America™

CAS: 1572-99-2 Molecular Formula: C6H9NO2 Molecular Weight (g/mol): 127.143 MDL Number: MFCD00013812 InChI Key: MIHRVXYXORIINI-UHFFFAOYSA-N Synonym: 2-Cyanopropionic Acid Ethyl Ester PubChem CID: 98018 ChEBI: CHEBI:51925 IUPAC Name: ethyl 2-cyanopropanoate SMILES: CCOC(=O)C(C)C#N

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PubChem CID	98018
CAS	1572-99-2
Molecular Weight (g/mol)	127.143
ChEBI	CHEBI:51925
MDL Number	MFCD00013812
SMILES	CCOC(=O)C(C)C#N
Synonym	2-Cyanopropionic Acid Ethyl Ester
IUPAC Name	ethyl 2-cyanopropanoate
InChI Key	MIHRVXYXORIINI-UHFFFAOYSA-N
Molecular Formula	C6H9NO2

677

4-Methyl-2-pentyl Acetate 98.0+%, TCI America™

CAS: 108-84-9 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00053723 InChI Key: CPIVYSAVIPTCCX-UHFFFAOYNA-N Synonym: Acetic Acid 1,3-Dimethylbutyl Ester, Acetic Acid 4-Methyl-2-pentyl Ester, 1,3-Dimethylbutyl Acetate PubChem CID: 7959 IUPAC Name: 4-methylpentan-2-yl acetate SMILES: CC(C)CC(C)OC(C)=O

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PubChem CID	7959
CAS	108-84-9
Molecular Weight (g/mol)	144.21
MDL Number	MFCD00053723
SMILES	CC(C)CC(C)OC(C)=O
Synonym	Acetic Acid 1,3-Dimethylbutyl Ester, Acetic Acid 4-Methyl-2-pentyl Ester, 1,3-Dimethylbutyl Acetate
IUPAC Name	4-methylpentan-2-yl acetate
InChI Key	CPIVYSAVIPTCCX-UHFFFAOYNA-N
Molecular Formula	C8H16O2

678

3-Phenylpropyl Acetate 98.0+%, TCI America™

CAS: 122-72-5 Molecular Formula: C11H14O2 Molecular Weight (g/mol): 178.231 MDL Number: MFCD00026216 InChI Key: JRJGKUTZNBZHNK-UHFFFAOYSA-N Synonym: hydrocinnamyl acetate,benzenepropanol, acetate,phenylpropyl acetate,3-phenyl-1-propyl acetate,3-acetoxypropyl benzene,3-phenyl-1-propanol, acetate,3-acetoxy-1-phenylpropane,1-acetoxy-3-phenylpropane,benzenepropanol, 1-acetate,benzenepropyl acetate PubChem CID: 31226 ChEBI: CHEBI:81257 IUPAC Name: 3-phenylpropyl acetate SMILES: CC(=O)OCCCC1=CC=CC=C1

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PubChem CID	31226
CAS	122-72-5
Molecular Weight (g/mol)	178.231
ChEBI	CHEBI:81257
MDL Number	MFCD00026216
SMILES	CC(=O)OCCCC1=CC=CC=C1
Synonym	hydrocinnamyl acetate,benzenepropanol, acetate,phenylpropyl acetate,3-phenyl-1-propyl acetate,3-acetoxypropyl benzene,3-phenyl-1-propanol, acetate,3-acetoxy-1-phenylpropane,1-acetoxy-3-phenylpropane,benzenepropanol, 1-acetate,benzenepropyl acetate
IUPAC Name	3-phenylpropyl acetate
InChI Key	JRJGKUTZNBZHNK-UHFFFAOYSA-N
Molecular Formula	C11H14O2

679

Ethyl 4-Acetyl-5-oxohexanoate 96.0+%, TCI America™

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680

3-Methylhexyl Acetate 95.0+%, TCI America™

CAS: 50373-54-1 Molecular Formula: C9H18O2 Molecular Weight (g/mol): 158.241 MDL Number: MFCD01321123 InChI Key: JASARFBWVJNEMI-UHFFFAOYSA-N Synonym: Acetic Acid 3-Methylhexyl Ester PubChem CID: 44630061 IUPAC Name: 3-methylhexyl acetate SMILES: CCCC(C)CCOC(=O)C

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Specifications

PubChem CID	44630061
CAS	50373-54-1
Molecular Weight (g/mol)	158.241
MDL Number	MFCD01321123
SMILES	CCCC(C)CCOC(=O)C
Synonym	Acetic Acid 3-Methylhexyl Ester
IUPAC Name	3-methylhexyl acetate
InChI Key	JASARFBWVJNEMI-UHFFFAOYSA-N
Molecular Formula	C9H18O2

681

2-Methylcyclohexyl Acetate 97.0+%, TCI America™

CAS: 5726-19-2 Molecular Formula: C9H16O2 Molecular Weight (g/mol): 156.23 MDL Number: MFCD00021390 InChI Key: AKIIJALHGMKJEJ-UHFFFAOYNA-N Synonym: Acetic Acid 2-Methylcyclohexyl Ester PubChem CID: 98345 IUPAC Name: 2-methylcyclohexyl acetate SMILES: CC1CCCCC1OC(C)=O

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Specifications

PubChem CID	98345
CAS	5726-19-2
Molecular Weight (g/mol)	156.23
MDL Number	MFCD00021390
SMILES	CC1CCCCC1OC(C)=O
Synonym	Acetic Acid 2-Methylcyclohexyl Ester
IUPAC Name	2-methylcyclohexyl acetate
InChI Key	AKIIJALHGMKJEJ-UHFFFAOYNA-N
Molecular Formula	C9H16O2

682

3-Acetoxypyridine 98.0+%, TCI America™

CAS: 17747-43-2 Molecular Formula: C7H7NO2 Molecular Weight (g/mol): 137.14 MDL Number: MFCD00006377 InChI Key: QZDWODWEESGPLC-UHFFFAOYSA-N Synonym: 3-Pyridyl Acetate PubChem CID: 87289 IUPAC Name: pyridin-3-yl acetate SMILES: CC(=O)OC1=CC=CN=C1

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PubChem CID	87289
CAS	17747-43-2
Molecular Weight (g/mol)	137.14
MDL Number	MFCD00006377
SMILES	CC(=O)OC1=CC=CN=C1
Synonym	3-Pyridyl Acetate
IUPAC Name	pyridin-3-yl acetate
InChI Key	QZDWODWEESGPLC-UHFFFAOYSA-N
Molecular Formula	C7H7NO2

683

2-Methylpentyl Acetate 98.0+%, TCI America™

CAS: 7789-99-3 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00060103 InChI Key: UZTVUHTZGGZFCI-UHFFFAOYNA-N Synonym: Acetic Acid 2-Methylpentyl Ester PubChem CID: 24625 IUPAC Name: 2-methylpentyl acetate SMILES: CCCC(C)COC(C)=O

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Specifications

PubChem CID	24625
CAS	7789-99-3
Molecular Weight (g/mol)	144.21
MDL Number	MFCD00060103
SMILES	CCCC(C)COC(C)=O
Synonym	Acetic Acid 2-Methylpentyl Ester
IUPAC Name	2-methylpentyl acetate
InChI Key	UZTVUHTZGGZFCI-UHFFFAOYNA-N
Molecular Formula	C8H16O2

684

2-Ethylhexyl 3-Mercaptopropionate 98.0+%, TCI America™

CAS: 50448-95-8 Molecular Formula: C11H22O2S Molecular Weight (g/mol): 218.355 MDL Number: MFCD00087933 InChI Key: SUODCTNNAKSRHB-UHFFFAOYSA-N Synonym: 3-Mercaptopropionic Acid 2-Ethylhexyl Ester, 3-Mercaptopropionic Acid Octyl Ester, 2-Octyl 3-Mercaptopropionate PubChem CID: 92640 IUPAC Name: 2-ethylhexyl 3-sulfanylpropanoate SMILES: CCCCC(CC)COC(=O)CCS

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PubChem CID	92640
CAS	50448-95-8
Molecular Weight (g/mol)	218.355
MDL Number	MFCD00087933
SMILES	CCCCC(CC)COC(=O)CCS
Synonym	3-Mercaptopropionic Acid 2-Ethylhexyl Ester, 3-Mercaptopropionic Acid Octyl Ester, 2-Octyl 3-Mercaptopropionate
IUPAC Name	2-ethylhexyl 3-sulfanylpropanoate
InChI Key	SUODCTNNAKSRHB-UHFFFAOYSA-N
Molecular Formula	C11H22O2S

685

tert-Butyl 3-Butenoate 95.0+%, TCI America™

CAS: 14036-55-6 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD06411714 InChI Key: NGASWKRTXGWPNN-UHFFFAOYSA-N Synonym: tert-butyl 3-butenoate,tert-butyl vinylacetate,3-butenoic acid tert-butyl ester,3-butenoic acid, 1,1-dimethylethyl ester,t-butyl vinylacetate,tert-butyl3-butenoate,tert-butyl-3-butenoate,acmc-20ajl7,vinylacetic acid tert-butyl ester,but-3-enoic acid tert-butyl ester PubChem CID: 639778 IUPAC Name: tert-butyl but-3-enoate SMILES: CC(C)(C)OC(=O)CC=C

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Specifications

PubChem CID	639778
CAS	14036-55-6
Molecular Weight (g/mol)	142.20
MDL Number	MFCD06411714
SMILES	CC(C)(C)OC(=O)CC=C
Synonym	tert-butyl 3-butenoate,tert-butyl vinylacetate,3-butenoic acid tert-butyl ester,3-butenoic acid, 1,1-dimethylethyl ester,t-butyl vinylacetate,tert-butyl3-butenoate,tert-butyl-3-butenoate,acmc-20ajl7,vinylacetic acid tert-butyl ester,but-3-enoic acid tert-butyl ester
IUPAC Name	tert-butyl but-3-enoate
InChI Key	NGASWKRTXGWPNN-UHFFFAOYSA-N
Molecular Formula	C8H14O2

686

4-Methylvaleric Acid 97.0+%, TCI America™

CAS: 646-07-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002803 InChI Key: FGKJLKRYENPLQH-UHFFFAOYSA-N Synonym: 4-methylvaleric acid,isocaproic acid,isohexanoic acid,pentanoic acid, 4-methyl,isobutylacetic acid,4-methyl-pentanoic acid,valeric acid, 4-methyl,4-methyl valeric acid,isocaproate,4,4-dimethylbutanoic acid PubChem CID: 12587 ChEBI: CHEBI:74903 IUPAC Name: 4-methylpentanoic acid SMILES: CC(C)CCC(=O)O

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Specifications

PubChem CID	12587
CAS	646-07-1
Molecular Weight (g/mol)	116.16
ChEBI	CHEBI:74903
MDL Number	MFCD00002803
SMILES	CC(C)CCC(=O)O
Synonym	4-methylvaleric acid,isocaproic acid,isohexanoic acid,pentanoic acid, 4-methyl,isobutylacetic acid,4-methyl-pentanoic acid,valeric acid, 4-methyl,4-methyl valeric acid,isocaproate,4,4-dimethylbutanoic acid
IUPAC Name	4-methylpentanoic acid
InChI Key	FGKJLKRYENPLQH-UHFFFAOYSA-N
Molecular Formula	C6H12O2

687

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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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

688

4-Methyl-2-propyl-6-benzimidazolecarboxylic Acid 98.0+%, TCI America™

CAS: 152628-03-0 Molecular Formula: C12H14N2O2 Molecular Weight (g/mol): 218.256 MDL Number: MFCD06656215 InChI Key: XWAJTVCEILFDGU-UHFFFAOYSA-N Synonym: 6-Carboxy-4-methyl-2-propylbenzimidazole PubChem CID: 10262831 IUPAC Name: 7-methyl-2-propyl-3H-benzimidazole-5-carboxylic acid SMILES: CCCC1=NC2=C(C=C(C=C2N1)C(=O)O)C

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PubChem CID	10262831
CAS	152628-03-0
Molecular Weight (g/mol)	218.256
MDL Number	MFCD06656215
SMILES	CCCC1=NC2=C(C=C(C=C2N1)C(=O)O)C
Synonym	6-Carboxy-4-methyl-2-propylbenzimidazole
IUPAC Name	7-methyl-2-propyl-3H-benzimidazole-5-carboxylic acid
InChI Key	XWAJTVCEILFDGU-UHFFFAOYSA-N
Molecular Formula	C12H14N2O2

689

4-Methylcyclohexanecarboxylic Acid (cis- and trans- mixture) 98.0+%, TCI America™

CAS: 4331-54-8 Molecular Formula: C8H14O2 Molecular Weight (g/mol): 142.20 MDL Number: MFCD00074943,MFCD00074909,MFCD20617670 InChI Key: QTDXSEZXAPHVBI-UHFFFAOYSA-N PubChem CID: 20330 IUPAC Name: 4-methylcyclohexane-1-carboxylic acid SMILES: CC1CCC(CC1)C(O)=O

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PubChem CID	20330
CAS	4331-54-8
Molecular Weight (g/mol)	142.20
MDL Number	MFCD00074943,MFCD00074909,MFCD20617670
SMILES	CC1CCC(CC1)C(O)=O
IUPAC Name	4-methylcyclohexane-1-carboxylic acid
InChI Key	QTDXSEZXAPHVBI-UHFFFAOYSA-N
Molecular Formula	C8H14O2

690

4-Pentenyl Acetate 98.0+%, TCI America™

CAS: 1576-85-8 Molecular Formula: C7H12O2 Molecular Weight (g/mol): 128.17 MDL Number: MFCD00008723 InChI Key: LVHDNIMNOMRZMF-UHFFFAOYSA-N Synonym: 4-pentenyl acetate,4-penten-1-yl acetate,5-acetoxy-1-pentene,unii-v4sif0mabv,pent-4-en-1-yl acetate,pent-4-ene-1-yl acetate,ch3c o o ch2 3ch=ch2,v4sif0mabv,4-penten-1-ol acetate,4-pentenyl acetate # PubChem CID: 74096 ChEBI: CHEBI:87515 IUPAC Name: pent-4-en-1-yl acetate SMILES: CC(=O)OCCCC=C

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PubChem CID	74096
CAS	1576-85-8
Molecular Weight (g/mol)	128.17
ChEBI	CHEBI:87515
MDL Number	MFCD00008723
SMILES	CC(=O)OCCCC=C
Synonym	4-pentenyl acetate,4-penten-1-yl acetate,5-acetoxy-1-pentene,unii-v4sif0mabv,pent-4-en-1-yl acetate,pent-4-ene-1-yl acetate,ch3c o o ch2 3ch=ch2,v4sif0mabv,4-penten-1-ol acetate,4-pentenyl acetate #
IUPAC Name	pent-4-en-1-yl acetate
InChI Key	LVHDNIMNOMRZMF-UHFFFAOYSA-N
Molecular Formula	C7H12O2

Monocarboxylic acids and derivatives

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