Structure via PubChem · Public domain (PubChem)
isocaproic acid
Sign in to saveAlso known as 4-Methyl-N-valeric acid, 4-Methyl-pentanoic acid, Isohexoic acid, Isobutylacetic acid, 4-Methyl-Valeric acid, Isohexanoic acid, 4,4-Dimethylbutanoic acid, 4-Methylvaleric acid
chemical compound
In the Vinony graph
Within Vinony's link graph, isocaproic acid is referenced by 12 other articles, and connects out to chemical formula, carboxylic acid and molar mass.
It sits within the topics Alkanoic acids, Chembox image size set and ECHA InfoCard ID from Wikidata.
Its subject is documented across 5 Wikipedia language editions.
Chemical data
- Formula
- C6H12O2
- Molecular weight
- 116.16 g/mol
- IUPAC name
- 4-methylpentanoic acid
- SMILES
- CC(C)CCC(=O)O
- InChIKey
- FGKJLKRYENPLQH-UHFFFAOYSA-N
- XLogP
- 1.4
- Polar surface area
- 37.3 Ų
- H-bond donors
- 1
- H-bond acceptors
- 2
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Mass
- 116.084
Show 5 more facts
- found in taxon
- Streptomyces
- chemical formula
- C₆H₁₂O₂
- canonical SMILES
- CC(C)CCC(=O)O
- melting point
- -35.0
- Commons category
- 4-Methylpentanoic acid
via Wikidata · CC0
Connections
chemical formula
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carboxylic acid
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molar mass
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CAS Registry Number
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organic acid
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simplified molecular input line entry specification
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methyl
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ChemSpider
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International Chemical Identifier
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European Chemicals Agency
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ChEBI
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standard state
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Jmol
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Unique Ingredient Identifier
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Preferred IUPAC name
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CompTox Chemistry Dashboard
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