1,1-difluoroethylcyclohexane

C8H14F2 — CID 14573096

IUPAC1,1-difluoroethylcyclohexane
SMILESCC(F)(F)C1CCCCC1
InChIInChI=1S/C8H14F2/c1-8(9,10)7-5-3-2-4-6-7/h7H,2-6H2,1H3
InChIKeyDBVMRQUISHFOFA-UHFFFAOYSA-N
MW148.20 g/mol
LogP3.22
Rot. Bonds1

About 1,1-difluoroethylcyclohexane

1,1-difluoroethylcyclohexane (PubChem CID 14573096) has the molecular formula C8H14F2 and a molecular weight of 148.20 g/mol. Its IUPAC name is 1,1-difluoroethylcyclohexane.

Molecular Properties

Compound Name1,1-difluoroethylcyclohexane
PubChem CID14573096
Molecular FormulaC8H14F2
Molecular Weight148.20 g/mol
Exact Mass148.11
IUPAC Name1,1-difluoroethylcyclohexane
SMILESCC(F)(F)C1CCCCC1
InChIInChI=1S/C8H14F2/c1-8(9,10)7-5-3-2-4-6-7/h7H,2-6H2,1H3
InChIKeyDBVMRQUISHFOFA-UHFFFAOYSA-N
XLogP3.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 53.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoroethylcyclohexane?
The IUPAC name of 1,1-difluoroethylcyclohexane (CID 14573096) is 1,1-difluoroethylcyclohexane.
What is the SMILES notation for 1,1-difluoroethylcyclohexane?
The canonical SMILES for 1,1-difluoroethylcyclohexane is CC(F)(F)C1CCCCC1.
What is the InChIKey of 1,1-difluoroethylcyclohexane?
The InChIKey is DBVMRQUISHFOFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14F2/c1-8(9,10)7-5-3-2-4-6-7/h7H,2-6H2,1H3.
What are the key properties of 1,1-difluoroethylcyclohexane?
1,1-difluoroethylcyclohexane has a molecular weight of 148.20 g/mol, XLogP of 3.22, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoroethylcyclohexane is sourced from PubChem (CID 14573096), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).