Summary

IMPPAT Phytochemical identifier: IMPHY016358

Phytochemical name: 3-Ethenylcyclooctene

Synonymous chemical names:
3-ethenylcyclooctene

External chemical identifiers:
CID:549002

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Chemical structure information

SMILES:
C=CC1CCCCCC=C1

InChI:
InChI=1S/C10H16/c1-2-10-8-6-4-3-5-7-9-10/h2,6,8,10H,1,3-5,7,9H2

InChIKey:
UHQZGHLWHFIZHF-UHFFFAOYSA-N

DeepSMILES:
C=CCCCCCCC=C8

Functional groups:
C=CC, CC=CC

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
C1=CCCCCCC1

Scaffold Graph/Node level:
C1CCCCCCC1

Scaffold Graph level:
C1CCCCCCC1

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Chemical classification

ClassyFire Kingdom: Organic compounds

ClassyFire Superclass: Hydrocarbons

ClassyFire Class: Unsaturated hydrocarbons

ClassyFire Subclass: Olefins

NP-Likeness score: 1.174

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Chemical structure download