2-METHYL-BUTANOIC-ACID

Structure

2D structure of 2-METHYL-BUTANOIC-ACID
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 8314

Names and identifiers

Name

2-METHYL-BUTANOIC-ACID

Also reported as

2-METHYL-BUTYRIC-ACID

IUPAC name

2-methylbutanoic acid

SMILES

CCC(C)C(=O)O

General information

Molecular formula

C5H10O2

Molecular weight

102.13 g/mol

Monoisotopic mass

102.0681 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

Chemical classification: NPClassifier (Kim et al., 2021)

Plants with the compound

Plant Plant part Amount Reference
Arctium lappa L. root -
Jim Duke's personal files.
Vaccinium myrtillus L. fruit 0 ppm
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.