2,2-dimethylcyclohexan-1-ol

C8H16O — CID 557637

IUPAC2,2-dimethylcyclohexan-1-ol
SMILESCC1(C)CCCCC1O
InChIInChI=1S/C8H16O/c1-8(2)6-4-3-5-7(8)9/h7,9H,3-6H2,1-2H3
InChIKeyBYBYZPFVXFPCND-UHFFFAOYSA-N
MW128.22 g/mol
LogP1.95
Rot. Bonds

About 2,2-dimethylcyclohexan-1-ol

2,2-dimethylcyclohexan-1-ol (PubChem CID 557637) has the molecular formula C8H16O and a molecular weight of 128.22 g/mol. Its IUPAC name is 2,2-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name2,2-dimethylcyclohexan-1-ol
PubChem CID557637
Molecular FormulaC8H16O
Molecular Weight128.22 g/mol
Exact Mass128.12
IUPAC Name2,2-dimethylcyclohexan-1-ol
SMILESCC1(C)CCCCC1O
InChIInChI=1S/C8H16O/c1-8(2)6-4-3-5-7(8)9/h7,9H,3-6H2,1-2H3
InChIKeyBYBYZPFVXFPCND-UHFFFAOYSA-N
XLogP1.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.22
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,7,7-tetramethylcyclooctan-1-ol
CID 130126588
(5R,11S)-spiro[5.5]undecane-5,11-diol
CID 10997722
(4S,5R,10R)-spiro[4.5]decane-4,10-diol
CID 14934378
(4S,5R)-spiro[4.5]decane-4,10-diol
CID 135069767
methanol;1,1,2-trimethylcyclohexane
CID 70292509
1-[(1S,2S)-2-hydroxy-1-methylcyclohexyl]ethanone
CID 42646159
(4S,5R,12R)-spiro[4.7]dodecane-4,12-diol
CID 11127251
trans-(1S,2S)-1-tert-butylcyclohexane-1,2-diol
CID 11969728
3-[(2,2-dimethylcyclohexyl)amino]-2,2-dimethylcyclobutan-1-ol
CID 112634164
5,5-dimethylcyclononan-1-ol
CID 130122952
1,1,2-trimethylcycloundecane
CID 544748
5-amino-2,2-dimethylcyclohexan-1-ol;hydrochloride
CID 89158271

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethylcyclohexan-1-ol?
The IUPAC name of 2,2-dimethylcyclohexan-1-ol (CID 557637) is 2,2-dimethylcyclohexan-1-ol.
What is the SMILES notation for 2,2-dimethylcyclohexan-1-ol?
The canonical SMILES for 2,2-dimethylcyclohexan-1-ol is CC1(C)CCCCC1O.
What is the InChIKey of 2,2-dimethylcyclohexan-1-ol?
The InChIKey is BYBYZPFVXFPCND-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16O/c1-8(2)6-4-3-5-7(8)9/h7,9H,3-6H2,1-2H3.
What are the key properties of 2,2-dimethylcyclohexan-1-ol?
2,2-dimethylcyclohexan-1-ol has a molecular weight of 128.22 g/mol, XLogP of 1.95, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethylcyclohexan-1-ol is sourced from PubChem (CID 557637), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).