2-OCTANONE

Structure

2D structure of 2-OCTANONE
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 8093

Names and identifiers

Name

2-OCTANONE

IUPAC name

octan-2-one

SMILES

CCCCCCC(=O)C

General information

Molecular formula

C8H16O

Molecular weight

128.22 g/mol

Monoisotopic mass

128.1201 Da

Classification

Pathway:
Superclass:
Class:
Glycoside:
No

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

Plants with the compound

Plant Plant part Amount Reference
Daucus carota L. seed -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.