Summary

IMPPAT Phytochemical identifier: IMPHY005995

Phytochemical name: 2-Methylpent-2-en-1-ol

Synonymous chemical names:
2-methyl-pent-2-en-1-al

External chemical identifiers:
CID:5362851, ZINC:ZINC000002039394, SureChEMBL:SCHEMBL712008

---

Chemical structure information

SMILES:
CC/C=C(/CO)C

InChI:
InChI=1S/C6H12O/c1-3-4-6(2)5-7/h4,7H,3,5H2,1-2H3/b6-4+

InChIKey:
KIKXGIRAIYTCRB-GQCTYLIASA-N

DeepSMILES:
CC/C=C/CO))C

Functional groups:
C/C=C(/C)C, CO

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Organic oxygen compounds

ClassyFire Class: Organooxygen compounds

ClassyFire Subclass: Alcohols and polyols

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Fatty alcohols

NP-Likeness score: 2.521

---

Chemical structure download