3-(difluoromethylidene)cyclohexene

C7H8F2 — CID 14226789

IUPAC3-(difluoromethylidene)cyclohexene
SMILESFC(F)=C1C=CCCC1
InChIInChI=1S/C7H8F2/c8-7(9)6-4-2-1-3-5-6/h2,4H,1,3,5H2
InChIKeyGKLZEXNXXRMARF-UHFFFAOYSA-N
MW130.14 g/mol
LogP2.88
Rot. Bonds

About 3-(difluoromethylidene)cyclohexene

3-(difluoromethylidene)cyclohexene (PubChem CID 14226789) has the molecular formula C7H8F2 and a molecular weight of 130.14 g/mol. Its IUPAC name is 3-(difluoromethylidene)cyclohexene.

Molecular Properties

Compound Name3-(difluoromethylidene)cyclohexene
PubChem CID14226789
Molecular FormulaC7H8F2
Molecular Weight130.14 g/mol
Exact Mass130.06
IUPAC Name3-(difluoromethylidene)cyclohexene
SMILESFC(F)=C1C=CCCC1
InChIInChI=1S/C7H8F2/c8-7(9)6-4-2-1-3-5-6/h2,4H,1,3,5H2
InChIKeyGKLZEXNXXRMARF-UHFFFAOYSA-N
XLogP2.88
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.14
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethylidene)cyclohexene?
The IUPAC name of 3-(difluoromethylidene)cyclohexene (CID 14226789) is 3-(difluoromethylidene)cyclohexene.
What is the SMILES notation for 3-(difluoromethylidene)cyclohexene?
The canonical SMILES for 3-(difluoromethylidene)cyclohexene is FC(F)=C1C=CCCC1.
What is the InChIKey of 3-(difluoromethylidene)cyclohexene?
The InChIKey is GKLZEXNXXRMARF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2/c8-7(9)6-4-2-1-3-5-6/h2,4H,1,3,5H2.
What are the key properties of 3-(difluoromethylidene)cyclohexene?
3-(difluoromethylidene)cyclohexene has a molecular weight of 130.14 g/mol, XLogP of 2.88, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethylidene)cyclohexene is sourced from PubChem (CID 14226789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).