[difluoro(methoxy)methyl]cyclohexane

C8H14F2O — CID 14491590

IUPAC[difluoro(methoxy)methyl]cyclohexane
SMILESCOC(F)(F)C1CCCCC1
InChIInChI=1S/C8H14F2O/c1-11-8(9,10)7-5-3-2-4-6-7/h7H,2-6H2,1H3
InChIKeyUVXGAAOAROQBIB-UHFFFAOYSA-N
MW164.19 g/mol
LogP2.81
Rot. Bonds2

About [difluoro(methoxy)methyl]cyclohexane

[difluoro(methoxy)methyl]cyclohexane (PubChem CID 14491590) has the molecular formula C8H14F2O and a molecular weight of 164.19 g/mol. Its IUPAC name is [difluoro(methoxy)methyl]cyclohexane.

Molecular Properties

Compound Name[difluoro(methoxy)methyl]cyclohexane
PubChem CID14491590
Molecular FormulaC8H14F2O
Molecular Weight164.19 g/mol
Exact Mass164.10
IUPAC Name[difluoro(methoxy)methyl]cyclohexane
SMILESCOC(F)(F)C1CCCCC1
InChIInChI=1S/C8H14F2O/c1-11-8(9,10)7-5-3-2-4-6-7/h7H,2-6H2,1H3
InChIKeyUVXGAAOAROQBIB-UHFFFAOYSA-N
XLogP2.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.19
LogP ≤ 52.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [difluoro(methoxy)methyl]cyclohexane?
The IUPAC name of [difluoro(methoxy)methyl]cyclohexane (CID 14491590) is [difluoro(methoxy)methyl]cyclohexane.
What is the SMILES notation for [difluoro(methoxy)methyl]cyclohexane?
The canonical SMILES for [difluoro(methoxy)methyl]cyclohexane is COC(F)(F)C1CCCCC1.
What is the InChIKey of [difluoro(methoxy)methyl]cyclohexane?
The InChIKey is UVXGAAOAROQBIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2O/c1-11-8(9,10)7-5-3-2-4-6-7/h7H,2-6H2,1H3.
What are the key properties of [difluoro(methoxy)methyl]cyclohexane?
[difluoro(methoxy)methyl]cyclohexane has a molecular weight of 164.19 g/mol, XLogP of 2.81, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [difluoro(methoxy)methyl]cyclohexane is sourced from PubChem (CID 14491590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).