3-OCTANOL

Structure

2D structure of 3-OCTANOL
2D structure
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3D model

Drawn and modelled with RDKit, 3D viewer 3Dmol.js. PubChem CID 246728

Names and identifiers

Name

3-OCTANOL

Also reported as

OCTAN-3-ONE

IUPAC name

octan-3-one

SMILES

CCCCCC(=O)CC

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
Glechoma hederacea L. - 1-2 ppm
Lawrence, B.M., Essential Oils 1976-1977, Essential Oils 1978, Essential Oils 1979-1980.
Mentha spicata L. essential oil -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.
Mentha spicata L. leaf -
Duke, J. A. Writeups or information summaries on approximately 2,000 economic plants, USDA, ARS, Beltsville, MD 20705.
Trifolium pratense L. subsp. pratense root -
Duke, James A. 1992. Handbook of phytochemical constituents of GRAS herbs and other economic plants. Boca Raton, FL. CRC Press.