1-ethenyl-6-methoxycyclohexene

C9H14O — CID 11029907

IUPAC1-ethenyl-6-methoxycyclohexene
SMILESC=CC1=CCCCC1OC
InChIInChI=1S/C9H14O/c1-3-8-6-4-5-7-9(8)10-2/h3,6,9H,1,4-5,7H2,2H3
InChIKeyUOKBFRVCYFLVHV-UHFFFAOYSA-N
MW138.21 g/mol
LogP2.30
Rot. Bonds2

About 1-ethenyl-6-methoxycyclohexene

1-ethenyl-6-methoxycyclohexene (PubChem CID 11029907) has the molecular formula C9H14O and a molecular weight of 138.21 g/mol. Its IUPAC name is 1-ethenyl-6-methoxycyclohexene.

Molecular Properties

Compound Name1-ethenyl-6-methoxycyclohexene
PubChem CID11029907
Molecular FormulaC9H14O
Molecular Weight138.21 g/mol
Exact Mass138.10
IUPAC Name1-ethenyl-6-methoxycyclohexene
SMILESC=CC1=CCCCC1OC
InChIInChI=1S/C9H14O/c1-3-8-6-4-5-7-9(8)10-2/h3,6,9H,1,4-5,7H2,2H3
InChIKeyUOKBFRVCYFLVHV-UHFFFAOYSA-N
XLogP2.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-6-methoxycyclohexene?
The IUPAC name of 1-ethenyl-6-methoxycyclohexene (CID 11029907) is 1-ethenyl-6-methoxycyclohexene.
What is the SMILES notation for 1-ethenyl-6-methoxycyclohexene?
The canonical SMILES for 1-ethenyl-6-methoxycyclohexene is C=CC1=CCCCC1OC.
What is the InChIKey of 1-ethenyl-6-methoxycyclohexene?
The InChIKey is UOKBFRVCYFLVHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14O/c1-3-8-6-4-5-7-9(8)10-2/h3,6,9H,1,4-5,7H2,2H3.
What are the key properties of 1-ethenyl-6-methoxycyclohexene?
1-ethenyl-6-methoxycyclohexene has a molecular weight of 138.21 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-6-methoxycyclohexene is sourced from PubChem (CID 11029907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).