6,6-dimethylcyclohexen-1-ol

C8H14O — CID 13047235

IUPAC6,6-dimethylcyclohexen-1-ol
SMILESCC1(C)CCCC=C1O
InChIInChI=1S/C8H14O/c1-8(2)6-4-3-5-7(8)9/h5,9H,3-4,6H2,1-2H3
InChIKeyHPFCZTAFMKCATL-UHFFFAOYSA-N
MW126.20 g/mol
LogP2.64
Rot. Bonds

About 6,6-dimethylcyclohexen-1-ol

6,6-dimethylcyclohexen-1-ol (PubChem CID 13047235) has the molecular formula C8H14O and a molecular weight of 126.20 g/mol. Its IUPAC name is 6,6-dimethylcyclohexen-1-ol.

Molecular Properties

Compound Name6,6-dimethylcyclohexen-1-ol
PubChem CID13047235
Molecular FormulaC8H14O
Molecular Weight126.20 g/mol
Exact Mass126.10
IUPAC Name6,6-dimethylcyclohexen-1-ol
SMILESCC1(C)CCCC=C1O
InChIInChI=1S/C8H14O/c1-8(2)6-4-3-5-7(8)9/h5,9H,3-4,6H2,1-2H3
InChIKeyHPFCZTAFMKCATL-UHFFFAOYSA-N
XLogP2.64
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 ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6,6-dimethylcyclohexen-1-ol?
The IUPAC name of 6,6-dimethylcyclohexen-1-ol (CID 13047235) is 6,6-dimethylcyclohexen-1-ol.
What is the SMILES notation for 6,6-dimethylcyclohexen-1-ol?
The canonical SMILES for 6,6-dimethylcyclohexen-1-ol is CC1(C)CCCC=C1O.
What is the InChIKey of 6,6-dimethylcyclohexen-1-ol?
The InChIKey is HPFCZTAFMKCATL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O/c1-8(2)6-4-3-5-7(8)9/h5,9H,3-4,6H2,1-2H3.
What are the key properties of 6,6-dimethylcyclohexen-1-ol?
6,6-dimethylcyclohexen-1-ol has a molecular weight of 126.20 g/mol, XLogP of 2.64, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,6-dimethylcyclohexen-1-ol is sourced from PubChem (CID 13047235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).