5,6-dimethylcyclohexen-1-ol

C8H14O — CID 59271555

IUPAC5,6-dimethylcyclohexen-1-ol
SMILESCC1CCC=C(O)C1C
InChIInChI=1S/C8H14O/c1-6-4-3-5-8(9)7(6)2/h5-7,9H,3-4H2,1-2H3
InChIKeyKMCROPJKNRNKPY-UHFFFAOYSA-N
MW126.20 g/mol
LogP2.49
Rot. Bonds

About 5,6-dimethylcyclohexen-1-ol

5,6-dimethylcyclohexen-1-ol (PubChem CID 59271555) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 5,6-dimethylcyclohexen-1-ol.

Molecular Properties

Compound Name5,6-dimethylcyclohexen-1-ol
PubChem CID59271555
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name5,6-dimethylcyclohexen-1-ol
SMILESCC1CCC=C(O)C1C
InChIInChI=1S/C8H14O/c1-6-4-3-5-8(9)7(6)2/h5-7,9H,3-4H2,1-2H3
InChIKeyKMCROPJKNRNKPY-UHFFFAOYSA-N
XLogP2.49
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500126.20
LogP ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethylcyclohexen-1-ol?
The IUPAC name of 5,6-dimethylcyclohexen-1-ol (CID 59271555) is 5,6-dimethylcyclohexen-1-ol.
What is the SMILES notation for 5,6-dimethylcyclohexen-1-ol?
The canonical SMILES for 5,6-dimethylcyclohexen-1-ol is CC1CCC=C(O)C1C.
What is the InChIKey of 5,6-dimethylcyclohexen-1-ol?
The InChIKey is KMCROPJKNRNKPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-6-4-3-5-8(9)7(6)2/h5-7,9H,3-4H2,1-2H3.
What are the key properties of 5,6-dimethylcyclohexen-1-ol?
5,6-dimethylcyclohexen-1-ol has a molecular weight of 126.20 g/mol, XLogP of 2.49, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethylcyclohexen-1-ol is sourced from PubChem (CID 59271555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).