2,2-difluoroethenylcyclohexane

C8H12F2 — CID 22182864

IUPAC2,2-difluoroethenylcyclohexane
SMILESFC(F)=CC1CCCCC1
InChIInChI=1S/C8H12F2/c9-8(10)6-7-4-2-1-3-5-7/h6-7H,1-5H2
InChIKeyYTGCLAROFHXGAC-UHFFFAOYSA-N
MW146.18 g/mol
LogP3.35
Rot. Bonds1

About 2,2-difluoroethenylcyclohexane

2,2-difluoroethenylcyclohexane (PubChem CID 22182864) has the molecular formula C8H12F2 and a molecular weight of 146.18 g/mol. Its IUPAC name is 2,2-difluoroethenylcyclohexane.

Molecular Properties

Compound Name2,2-difluoroethenylcyclohexane
PubChem CID22182864
Molecular FormulaC8H12F2
Molecular Weight146.18 g/mol
Exact Mass146.09
IUPAC Name2,2-difluoroethenylcyclohexane
SMILESFC(F)=CC1CCCCC1
InChIInChI=1S/C8H12F2/c9-8(10)6-7-4-2-1-3-5-7/h6-7H,1-5H2
InChIKeyYTGCLAROFHXGAC-UHFFFAOYSA-N
XLogP3.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.18
LogP ≤ 53.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoroethenylcyclohexane?
The IUPAC name of 2,2-difluoroethenylcyclohexane (CID 22182864) is 2,2-difluoroethenylcyclohexane.
What is the SMILES notation for 2,2-difluoroethenylcyclohexane?
The canonical SMILES for 2,2-difluoroethenylcyclohexane is FC(F)=CC1CCCCC1.
What is the InChIKey of 2,2-difluoroethenylcyclohexane?
The InChIKey is YTGCLAROFHXGAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12F2/c9-8(10)6-7-4-2-1-3-5-7/h6-7H,1-5H2.
What are the key properties of 2,2-difluoroethenylcyclohexane?
2,2-difluoroethenylcyclohexane has a molecular weight of 146.18 g/mol, XLogP of 3.35, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoroethenylcyclohexane is sourced from PubChem (CID 22182864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).