1-cyclohexyl-2,2-difluoroethanol

C8H14F2O — CID 11008259

IUPAC1-cyclohexyl-2,2-difluoroethanol
SMILESOC(C(F)F)C1CCCCC1
InChIInChI=1S/C8H14F2O/c9-8(10)7(11)6-4-2-1-3-5-6/h6-8,11H,1-5H2
InChIKeyXQWBMOVANRFWLI-UHFFFAOYSA-N
MW164.20 g/mol
LogP2.19
Rot. Bonds2

About 1-cyclohexyl-2,2-difluoroethanol

1-cyclohexyl-2,2-difluoroethanol (PubChem CID 11008259) has the molecular formula C8H14F2O and a molecular weight of 164.20 g/mol. Its IUPAC name is 1-cyclohexyl-2,2-difluoroethanol.

Molecular Properties

Compound Name1-cyclohexyl-2,2-difluoroethanol
PubChem CID11008259
Molecular FormulaC8H14F2O
Molecular Weight164.20 g/mol
Exact Mass164.10
IUPAC Name1-cyclohexyl-2,2-difluoroethanol
SMILESOC(C(F)F)C1CCCCC1
InChIInChI=1S/C8H14F2O/c9-8(10)7(11)6-4-2-1-3-5-6/h6-8,11H,1-5H2
InChIKeyXQWBMOVANRFWLI-UHFFFAOYSA-N
XLogP2.19
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.20
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-Cyclohexylethanol
CID 137829
alpha-Methylcyclohexanepropanol
CID 112065
1-Cyclohexyl-1-propanol
CID 86535
4-(Trifluoromethyl)cyclohexan-1-ol
CID 2779765
Cyclohexanemethanol, alpha-propyl-
CID 107269
2-(Trifluoromethyl)cyclohexanol
CID 2777485
3-(Trifluoromethyl)cyclohexan-1-ol
CID 2777487
1-Cyclohexylethanol, (S)-
CID 9964092
1-Cyclohexyl-2,2,2-trifluoroethan-1-ol
CID 10943092
(alphaR)-alpha-Methylcyclohexanemethanol
CID 10290808
(4,4-Difluorocyclohexyl)methanol
CID 21184133
1-Cyclohexyl-1-propanol, (R)-
CID 10964625

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2,2-difluoroethanol?
The IUPAC name of 1-cyclohexyl-2,2-difluoroethanol (CID 11008259) is 1-cyclohexyl-2,2-difluoroethanol.
What is the SMILES notation for 1-cyclohexyl-2,2-difluoroethanol?
The canonical SMILES for 1-cyclohexyl-2,2-difluoroethanol is OC(C(F)F)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2,2-difluoroethanol?
The InChIKey is XQWBMOVANRFWLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2O/c9-8(10)7(11)6-4-2-1-3-5-6/h6-8,11H,1-5H2.
What are the key properties of 1-cyclohexyl-2,2-difluoroethanol?
1-cyclohexyl-2,2-difluoroethanol has a molecular weight of 164.20 g/mol, XLogP of 2.19, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2,2-difluoroethanol is sourced from PubChem (CID 11008259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).