ethenylcyclohexane

C8H14 — CID 12757

IUPACethenylcyclohexane
SMILESC=CC1CCCCC1
InChIInChI=1S/C8H14/c1-2-8-6-4-3-5-7-8/h2,8H,1,3-7H2
InChIKeyLDLDYFCCDKENPD-UHFFFAOYSA-N
MW110.20 g/mol
LogP2.75
Rot. Bonds1

About ethenylcyclohexane

ethenylcyclohexane (PubChem CID 12757) has the molecular formula C8H14 and a molecular weight of 110.20 g/mol. Its IUPAC name is ethenylcyclohexane.

Molecular Properties

Compound Nameethenylcyclohexane
PubChem CID12757
Molecular FormulaC8H14
Molecular Weight110.20 g/mol
Exact Mass110.11
IUPAC Nameethenylcyclohexane
SMILESC=CC1CCCCC1
InChIInChI=1S/C8H14/c1-2-8-6-4-3-5-7-8/h2,8H,1,3-7H2
InChIKeyLDLDYFCCDKENPD-UHFFFAOYSA-N
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.20
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Allylcyclohexane
CID 75027
Cyclohexylallene
CID 21873
Allylcyclopentane
CID 77059
1-Methyl-4-methylidenecyclohexane
CID 520363
1,2-Diethenylcyclohexane
CID 70491
3-(Prop-2-en-1-yl)cyclohex-1-ene
CID 139918
1-Octene, 6-methyl-
CID 518716
4-Methyl-1-octene
CID 518717
1-Methyl-2-methylenecyclohexane
CID 137725
rel-(1R,2S)-1,2-Diethenylcyclohexane
CID 14906634
5-Cyclohexyl-1-pentene
CID 523968
5-Methyl-1-octene
CID 527118

Frequently Asked Questions

What is the IUPAC name of ethenylcyclohexane?
The IUPAC name of ethenylcyclohexane (CID 12757) is ethenylcyclohexane.
What is the SMILES notation for ethenylcyclohexane?
The canonical SMILES for ethenylcyclohexane is C=CC1CCCCC1.
What is the InChIKey of ethenylcyclohexane?
The InChIKey is LDLDYFCCDKENPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14/c1-2-8-6-4-3-5-7-8/h2,8H,1,3-7H2.
What are the key properties of ethenylcyclohexane?
ethenylcyclohexane has a molecular weight of 110.20 g/mol, XLogP of 2.75, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethenylcyclohexane is sourced from PubChem (CID 12757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).