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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

Isobutyl Isobutyrate 98.0+%, TCI America™

CAS: 97-85-8 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00008916 InChI Key: RXGUIWHIADMCFC-UHFFFAOYSA-N Synonym: isobutyl isobutyrate,isobutyl 2-methylpropanoate,isobutyl isobutanoate,isobutyric acid, isobutyl ester,propanoic acid, 2-methyl-, 2-methylpropyl ester,2-methylpropyl 2-methylpropionate,2-methylpropyl isobutyrate,isobutylester kyseliny isomaselne,fema number 2189,2-methyl-1-propyl 2-methylpropanoate PubChem CID: 7351 IUPAC Name: 2-methylpropyl 2-methylpropanoate SMILES: CC(C)COC(=O)C(C)C

PubChem CID 7351
CAS 97-85-8
Molecular Weight (g/mol) 144.21
MDL Number MFCD00008916
SMILES CC(C)COC(=O)C(C)C
Synonym isobutyl isobutyrate,isobutyl 2-methylpropanoate,isobutyl isobutanoate,isobutyric acid, isobutyl ester,propanoic acid, 2-methyl-, 2-methylpropyl ester,2-methylpropyl 2-methylpropionate,2-methylpropyl isobutyrate,isobutylester kyseliny isomaselne,fema number 2189,2-methyl-1-propyl 2-methylpropanoate
IUPAC Name 2-methylpropyl 2-methylpropanoate
InChI Key RXGUIWHIADMCFC-UHFFFAOYSA-N
Molecular Formula C8H16O2
2

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

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
3

Isopropyl Acetate, Puriss p.a., ≥99.5% (GC), Solstice

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
4
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Isobutyl isobutyrate, 98%

CAS: 97-85-8 Molecular Formula: C8H16O2 Molecular Weight (g/mol): 144.21 MDL Number: MFCD00008916 InChI Key: RXGUIWHIADMCFC-UHFFFAOYSA-N Synonym: isobutyl isobutyrate,isobutyl 2-methylpropanoate,isobutyl isobutanoate,isobutyric acid, isobutyl ester,propanoic acid, 2-methyl-, 2-methylpropyl ester,2-methylpropyl 2-methylpropionate,2-methylpropyl isobutyrate,isobutylester kyseliny isomaselne,fema number 2189,2-methyl-1-propyl 2-methylpropanoate PubChem CID: 7351 IUPAC Name: 2-methylpropyl 2-methylpropanoate SMILES: CC(C)COC(=O)C(C)C

PubChem CID 7351
CAS 97-85-8
Molecular Weight (g/mol) 144.21
MDL Number MFCD00008916
SMILES CC(C)COC(=O)C(C)C
Synonym isobutyl isobutyrate,isobutyl 2-methylpropanoate,isobutyl isobutanoate,isobutyric acid, isobutyl ester,propanoic acid, 2-methyl-, 2-methylpropyl ester,2-methylpropyl 2-methylpropionate,2-methylpropyl isobutyrate,isobutylester kyseliny isomaselne,fema number 2189,2-methyl-1-propyl 2-methylpropanoate
IUPAC Name 2-methylpropyl 2-methylpropanoate
InChI Key RXGUIWHIADMCFC-UHFFFAOYSA-N
Molecular Formula C8H16O2
5
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2-Methylvaleric acid, 98+%

CAS: 97-61-0 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002671 InChI Key: OVBFMEVBMNZIBR-UHFFFAOYSA-N Synonym: 2-methylvaleric acid,pentanoic acid, 2-methyl,valeric acid, 2-methyl,methylpropylacetic acid,2-pentanecarboxylic acid,2-methyl valeric acid,alpha-methylvaleric acid,pentanoic acid, methyl,kyselina 2-methylvalerova,fema no. 2754 PubChem CID: 7341 IUPAC Name: 2-methylpentanoic acid SMILES: CCCC(C)C(=O)O

PubChem CID 7341
CAS 97-61-0
Molecular Weight (g/mol) 116.16
MDL Number MFCD00002671
SMILES CCCC(C)C(=O)O
Synonym 2-methylvaleric acid,pentanoic acid, 2-methyl,valeric acid, 2-methyl,methylpropylacetic acid,2-pentanecarboxylic acid,2-methyl valeric acid,alpha-methylvaleric acid,pentanoic acid, methyl,kyselina 2-methylvalerova,fema no. 2754
IUPAC Name 2-methylpentanoic acid
InChI Key OVBFMEVBMNZIBR-UHFFFAOYSA-N
Molecular Formula C6H12O2
6
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3-Methylvaleric acid, 99%

CAS: 105-43-1 Molecular Formula: C6H12O2 Molecular Weight (g/mol): 116.16 MDL Number: MFCD00002729,MFCD02262177 InChI Key: IGIDLTISMCAULB-UHFFFAOYNA-N Synonym: 3-methylvaleric acid,3-methyl-pentanoic acid,pentanoic acid, 3-methyl,3-methyl valeric acid,dl-3-methylvaleric acid,3-methyl pentanoic acid,sec-butylacetic acid,valeric acid, 3-methyl,beta-methylvaleric acid,3-methyl-n-valeric acid PubChem CID: 7755 IUPAC Name: 3-methylpentanoic acid SMILES: CCC(C)CC(O)=O

PubChem CID 7755
CAS 105-43-1
Molecular Weight (g/mol) 116.16
MDL Number MFCD00002729,MFCD02262177
SMILES CCC(C)CC(O)=O
Synonym 3-methylvaleric acid,3-methyl-pentanoic acid,pentanoic acid, 3-methyl,3-methyl valeric acid,dl-3-methylvaleric acid,3-methyl pentanoic acid,sec-butylacetic acid,valeric acid, 3-methyl,beta-methylvaleric acid,3-methyl-n-valeric acid
IUPAC Name 3-methylpentanoic acid
InChI Key IGIDLTISMCAULB-UHFFFAOYNA-N
Molecular Formula C6H12O2
7
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Pyrazolo[1,5-a]pyrimidine-2-carboxylic acid, 97%, Thermo Scientific™

CAS: 378211-85-9 Molecular Formula: C7H5N3O2 Molecular Weight (g/mol): 163.14 MDL Number: MFCD00297221 InChI Key: DZPAOAZDQHZRGG-UHFFFAOYSA-N Synonym: pyrazolo 1,5-a pyrimidine-2-carboxylic acid,8-hydropyrazolo 1,5-a pyrimidine-2-carboxylic acid,2-pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylicacid,acmc-1afu0,pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1?5-a pyrimidine-2-carboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylic acid 9ci,2-methyl-3-2-trimethylsilyl ethoxy methyl-3h-imidazo 4,5-b pyridin-6-yl boronic acid PubChem CID: 670824 IUPAC Name: pyrazolo[1,5-a]pyrimidine-2-carboxylic acid SMILES: C1=CN2C(=CC(=N2)C(=O)O)N=C1

PubChem CID 670824
CAS 378211-85-9
Molecular Weight (g/mol) 163.14
MDL Number MFCD00297221
SMILES C1=CN2C(=CC(=N2)C(=O)O)N=C1
Synonym pyrazolo 1,5-a pyrimidine-2-carboxylic acid,8-hydropyrazolo 1,5-a pyrimidine-2-carboxylic acid,2-pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylicacid,acmc-1afu0,pyrazolo 1,5-a pyrimidinecarboxylic acid,pyrazolo 1?5-a pyrimidine-2-carboxylic acid,pyrazolo 1,5-a pyrimidine-2-carboxylic acid 9ci,2-methyl-3-2-trimethylsilyl ethoxy methyl-3h-imidazo 4,5-b pyridin-6-yl boronic acid
IUPAC Name pyrazolo[1,5-a]pyrimidine-2-carboxylic acid
InChI Key DZPAOAZDQHZRGG-UHFFFAOYSA-N
Molecular Formula C7H5N3O2
8

Sigma Aldrich Behenic acid

MilliporeSigma Sigma Organics products encompass a wide range of quality reagents, solvents, catalysts, and building blocks for organic synthesis. From benchtop discovery to process development and scale-up, Sigma Organics solutions are built to meet the needs of synthetic chemists.

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CAS 112-85-6