Summary

IMPPAT Phytochemical identifier: IMPHY015271

Phytochemical name: 2-Methyloctan-1-ol

Synonymous chemical names:
2-methyl-1-octanol

External chemical identifiers:
CID:102495, FDASRS:4FT7336DZ7, SureChEMBL:SCHEMBL226264, MolPort-006-112-435

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Chemical structure information

SMILES:
CCCCCCC(CO)C

InChI:
InChI=1S/C9H20O/c1-3-4-5-6-7-9(2)8-10/h9-10H,3-8H2,1-2H3

InChIKey:
IGVGCQGTEINVOH-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCO))C

Functional groups:
CO

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Lipids and lipid-like molecules

ClassyFire Class: Fatty acyls

ClassyFire Subclass: Fatty alcohols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 1.609

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Chemical structure download