Summary

IMPPAT Phytochemical identifier: IMPHY012116

Phytochemical name: 2-Methyl-2-butene

Synonymous chemical names:
2-methyl-2-butene

External chemical identifiers:
CID:10553, ChEBI:77916, ZINC:ZINC000001699503, FDASRS:HR68LQ4T3X, SureChEMBL:SCHEMBL20475, MolPort-001-783-187

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Chemical structure information

SMILES:
CC=C(C)C

InChI:
InChI=1S/C5H10/c1-4-5(2)3/h4H,1-3H3

InChIKey:
BKOOMYPCSUNDGP-UHFFFAOYSA-N

DeepSMILES:
CC=CC)C

Functional groups:
CC=C(C)C

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Branched unsaturated hydrocarbons

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 1.406

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Chemical structure download