1,4-bis(difluoromethylidene)cyclohexane

C8H8F4 — CID 12965536

IUPAC1,4-bis(difluoromethylidene)cyclohexane
SMILESFC(F)=C1CCC(=C(F)F)CC1
InChIInChI=1S/C8H8F4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H2
InChIKeyXKRPPRFTUFANHT-UHFFFAOYSA-N
MW180.14 g/mol
LogP3.86
Rot. Bonds

About 1,4-bis(difluoromethylidene)cyclohexane

1,4-bis(difluoromethylidene)cyclohexane (PubChem CID 12965536) has the molecular formula C8H8F4 and a molecular weight of 180.14 g/mol. Its IUPAC name is 1,4-bis(difluoromethylidene)cyclohexane.

Molecular Properties

Compound Name1,4-bis(difluoromethylidene)cyclohexane
PubChem CID12965536
Molecular FormulaC8H8F4
Molecular Weight180.14 g/mol
Exact Mass180.06
IUPAC Name1,4-bis(difluoromethylidene)cyclohexane
SMILESFC(F)=C1CCC(=C(F)F)CC1
InChIInChI=1S/C8H8F4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H2
InChIKeyXKRPPRFTUFANHT-UHFFFAOYSA-N
XLogP3.86
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.14
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,4-bis(difluoromethylidene)cyclohexane?
The IUPAC name of 1,4-bis(difluoromethylidene)cyclohexane (CID 12965536) is 1,4-bis(difluoromethylidene)cyclohexane.
What is the SMILES notation for 1,4-bis(difluoromethylidene)cyclohexane?
The canonical SMILES for 1,4-bis(difluoromethylidene)cyclohexane is FC(F)=C1CCC(=C(F)F)CC1.
What is the InChIKey of 1,4-bis(difluoromethylidene)cyclohexane?
The InChIKey is XKRPPRFTUFANHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F4/c9-7(10)5-1-2-6(4-3-5)8(11)12/h1-4H2.
What are the key properties of 1,4-bis(difluoromethylidene)cyclohexane?
1,4-bis(difluoromethylidene)cyclohexane has a molecular weight of 180.14 g/mol, XLogP of 3.86, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(difluoromethylidene)cyclohexane is sourced from PubChem (CID 12965536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).