1-cyclohexyl-2,2-difluoroethanol;hydrochloride

C8H15ClF2O — CID 162337180

IUPAC1-cyclohexyl-2,2-difluoroethanol;hydrochloride
SMILESCl.OC(C(F)F)C1CCCCC1
InChIInChI=1S/C8H14F2O.ClH/c9-8(10)7(11)6-4-2-1-3-5-6;/h6-8,11H,1-5H2;1H
InChIKeyFWYRDVMRUQZVQP-UHFFFAOYSA-N
MW200.66 g/mol
LogP2.61
Rot. Bonds2

About 1-cyclohexyl-2,2-difluoroethanol;hydrochloride

1-cyclohexyl-2,2-difluoroethanol;hydrochloride (PubChem CID 162337180) has the molecular formula C8H15ClF2O and a molecular weight of 200.66 g/mol. Its IUPAC name is 1-cyclohexyl-2,2-difluoroethanol;hydrochloride.

Molecular Properties

Compound Name1-cyclohexyl-2,2-difluoroethanol;hydrochloride
PubChem CID162337180
Molecular FormulaC8H15ClF2O
Molecular Weight200.66 g/mol
Exact Mass200.08
IUPAC Name1-cyclohexyl-2,2-difluoroethanol;hydrochloride
SMILESCl.OC(C(F)F)C1CCCCC1
InChIInChI=1S/C8H14F2O.ClH/c9-8(10)7(11)6-4-2-1-3-5-6;/h6-8,11H,1-5H2;1H
InChIKeyFWYRDVMRUQZVQP-UHFFFAOYSA-N
XLogP2.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.66
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 103459295
difluoromethylcyclohexane
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1-cycloheptylpropane-1,2-diol
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(2S)-2-amino-1-cyclohexylpropan-1-ol;hydrochloride
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cyclooctyl(cyclopropyl)methanol
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2,3-diamino-1-cyclohexylpropan-1-ol;dihydrochloride
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1-(4-tert-butylcyclohexyl)-2,2-difluoroethanol
CID 115694405
[chloro(fluoro)methyl]cyclohexane
CID 134937924
CID 59303636
CID 59303636
1-(3-ethylcyclohexyl)-2,2-difluoroethanol
CID 112699179
(1R,2S)-2-amino-1-cyclohexyl-2-(2,6-dimethylphenyl)ethanol;hydrochloride
CID 171267921

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2,2-difluoroethanol;hydrochloride?
The IUPAC name of 1-cyclohexyl-2,2-difluoroethanol;hydrochloride (CID 162337180) is 1-cyclohexyl-2,2-difluoroethanol;hydrochloride.
What is the SMILES notation for 1-cyclohexyl-2,2-difluoroethanol;hydrochloride?
The canonical SMILES for 1-cyclohexyl-2,2-difluoroethanol;hydrochloride is Cl.OC(C(F)F)C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2,2-difluoroethanol;hydrochloride?
The InChIKey is FWYRDVMRUQZVQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2O.ClH/c9-8(10)7(11)6-4-2-1-3-5-6;/h6-8,11H,1-5H2;1H.
What are the key properties of 1-cyclohexyl-2,2-difluoroethanol;hydrochloride?
1-cyclohexyl-2,2-difluoroethanol;hydrochloride has a molecular weight of 200.66 g/mol, XLogP of 2.61, 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;hydrochloride is sourced from PubChem (CID 162337180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).