2-(trifluoromethyl)cyclohexan-1-ol

C7H11F3O — CID 2777485

IUPAC2-(trifluoromethyl)cyclohexan-1-ol
SMILESOC1CCCCC1C(F)(F)F
InChIInChI=1S/C7H11F3O/c8-7(9,10)5-3-1-2-4-6(5)11/h5-6,11H,1-4H2
InChIKeyBGAGPUHWVOHHTP-UHFFFAOYSA-N
MW168.16 g/mol
LogP2.10
Rot. Bonds

About 2-(trifluoromethyl)cyclohexan-1-ol

2-(trifluoromethyl)cyclohexan-1-ol (PubChem CID 2777485) has the molecular formula C7H11F3O and a molecular weight of 168.16 g/mol. Its IUPAC name is 2-(trifluoromethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name2-(trifluoromethyl)cyclohexan-1-ol
PubChem CID2777485
Molecular FormulaC7H11F3O
Molecular Weight168.16 g/mol
Exact Mass168.08
IUPAC Name2-(trifluoromethyl)cyclohexan-1-ol
SMILESOC1CCCCC1C(F)(F)F
InChIInChI=1S/C7H11F3O/c8-7(9,10)5-3-1-2-4-6(5)11/h5-6,11H,1-4H2
InChIKeyBGAGPUHWVOHHTP-UHFFFAOYSA-N
XLogP2.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.16
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(trifluoromethyl)cyclohexan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)cyclohexan-1-ol?
The IUPAC name of 2-(trifluoromethyl)cyclohexan-1-ol (CID 2777485) is 2-(trifluoromethyl)cyclohexan-1-ol.
What is the SMILES notation for 2-(trifluoromethyl)cyclohexan-1-ol?
The canonical SMILES for 2-(trifluoromethyl)cyclohexan-1-ol is OC1CCCCC1C(F)(F)F.
What is the InChIKey of 2-(trifluoromethyl)cyclohexan-1-ol?
The InChIKey is BGAGPUHWVOHHTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3O/c8-7(9,10)5-3-1-2-4-6(5)11/h5-6,11H,1-4H2.
What are the key properties of 2-(trifluoromethyl)cyclohexan-1-ol?
2-(trifluoromethyl)cyclohexan-1-ol has a molecular weight of 168.16 g/mol, XLogP of 2.10, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)cyclohexan-1-ol is sourced from PubChem (CID 2777485), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).