2-ethenyl-2,4-dimethylcyclohexan-1-ol

C10H18O — CID 58534253

IUPAC2-ethenyl-2,4-dimethylcyclohexan-1-ol
SMILESC=CC1(C)CC(C)CCC1O
InChIInChI=1S/C10H18O/c1-4-10(3)7-8(2)5-6-9(10)11/h4,8-9,11H,1,5-7H2,2-3H3
InChIKeyXXCJKBKVCKSIQE-UHFFFAOYSA-N
MW154.25 g/mol
LogP2.36
Rot. Bonds1

About 2-ethenyl-2,4-dimethylcyclohexan-1-ol

2-ethenyl-2,4-dimethylcyclohexan-1-ol (PubChem CID 58534253) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 2-ethenyl-2,4-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name2-ethenyl-2,4-dimethylcyclohexan-1-ol
PubChem CID58534253
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name2-ethenyl-2,4-dimethylcyclohexan-1-ol
SMILESC=CC1(C)CC(C)CCC1O
InChIInChI=1S/C10H18O/c1-4-10(3)7-8(2)5-6-9(10)11/h4,8-9,11H,1,5-7H2,2-3H3
InChIKeyXXCJKBKVCKSIQE-UHFFFAOYSA-N
XLogP2.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-2,4-dimethylcyclohexan-1-ol?
The IUPAC name of 2-ethenyl-2,4-dimethylcyclohexan-1-ol (CID 58534253) is 2-ethenyl-2,4-dimethylcyclohexan-1-ol.
What is the SMILES notation for 2-ethenyl-2,4-dimethylcyclohexan-1-ol?
The canonical SMILES for 2-ethenyl-2,4-dimethylcyclohexan-1-ol is C=CC1(C)CC(C)CCC1O.
What is the InChIKey of 2-ethenyl-2,4-dimethylcyclohexan-1-ol?
The InChIKey is XXCJKBKVCKSIQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O/c1-4-10(3)7-8(2)5-6-9(10)11/h4,8-9,11H,1,5-7H2,2-3H3.
What are the key properties of 2-ethenyl-2,4-dimethylcyclohexan-1-ol?
2-ethenyl-2,4-dimethylcyclohexan-1-ol has a molecular weight of 154.25 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-2,4-dimethylcyclohexan-1-ol is sourced from PubChem (CID 58534253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).