Summary

IMPPAT Phytochemical identifier: IMPHY005682

Phytochemical name: 2-Methyldecane

Synonymous chemical names:
2-methyl decane, 2-methyl-decane, 2-methyldecane, decane,2-methyl

External chemical identifiers:
CID:23415, ZINC:ZINC000001571092, SureChEMBL:SCHEMBL954162, MolPort-006-118-425

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Chemical structure information

SMILES:
CCCCCCCCC(C)C

InChI:
InChI=1S/C11H24/c1-4-5-6-7-8-9-10-11(2)3/h11H,4-10H2,1-3H3

InChIKey:
CNPVJWYWYZMPDS-UHFFFAOYSA-N

DeepSMILES:
CCCCCCCCCC)C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Saturated hydrocarbons

ClassyFire Subclass: Alkanes

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 0.605

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Chemical structure download