5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol

C12H24O — CID 134223783

IUPAC5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol
SMILESCC(C)CC1CCC(C)(C)CC1O
InChIInChI=1S/C12H24O/c1-9(2)7-10-5-6-12(3,4)8-11(10)13/h9-11,13H,5-8H2,1-4H3
InChIKeyVJHPPNYVTUUJOX-UHFFFAOYSA-N
MW184.32 g/mol
LogP3.22
Rot. Bonds2

About 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol

5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol (PubChem CID 134223783) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol.

Molecular Properties

Compound Name5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol
PubChem CID134223783
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol
SMILESCC(C)CC1CCC(C)(C)CC1O
InChIInChI=1S/C12H24O/c1-9(2)7-10-5-6-12(3,4)8-11(10)13/h9-11,13H,5-8H2,1-4H3
InChIKeyVJHPPNYVTUUJOX-UHFFFAOYSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol?
The IUPAC name of 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol (CID 134223783) is 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol.
What is the SMILES notation for 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol?
The canonical SMILES for 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol is CC(C)CC1CCC(C)(C)CC1O.
What is the InChIKey of 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol?
The InChIKey is VJHPPNYVTUUJOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-9(2)7-10-5-6-12(3,4)8-11(10)13/h9-11,13H,5-8H2,1-4H3.
What are the key properties of 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol?
5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol has a molecular weight of 184.32 g/mol, XLogP of 3.22, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-2-(2-methylpropyl)cyclohexan-1-ol is sourced from PubChem (CID 134223783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).