Summary

IMPPAT Phytochemical identifier: IMPHY015262

Phytochemical name: 2-Heptene

Synonymous chemical names:
2-heptene

External chemical identifiers:
CID:11611

---

Chemical structure information

SMILES:
CCCCC=CC

InChI:
InChI=1S/C7H14/c1-3-5-7-6-4-2/h3,5H,4,6-7H2,1-2H3

InChIKey:
OTTZHAVKAVGASB-UHFFFAOYSA-N

DeepSMILES:
CCCCC=CC

Functional groups:
CC=CC

---

Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Unsaturated aliphatic hydrocarbons

NP Classifier Biosynthetic pathway: Fatty acids

NP Classifier Superclass: Fatty acyls

NP Classifier Class: Hydrocarbons

NP-Likeness score: 2.039

---

Chemical structure download