3-(difluoromethylidene)-1,1-difluorocyclobutane

C5H4F4 — CID 12637092

IUPAC3-(difluoromethylidene)-1,1-difluorocyclobutane
SMILESFC(F)=C1CC(F)(F)C1
InChIInChI=1S/C5H4F4/c6-4(7)3-1-5(8,9)2-3/h1-2H2
InChIKeyXMRDAUYSJKWRRU-UHFFFAOYSA-N
MW140.08 g/mol
LogP2.57
Rot. Bonds

About 3-(difluoromethylidene)-1,1-difluorocyclobutane

3-(difluoromethylidene)-1,1-difluorocyclobutane (PubChem CID 12637092) has the molecular formula C5H4F4 and a molecular weight of 140.08 g/mol. Its IUPAC name is 3-(difluoromethylidene)-1,1-difluorocyclobutane.

Molecular Properties

Compound Name3-(difluoromethylidene)-1,1-difluorocyclobutane
PubChem CID12637092
Molecular FormulaC5H4F4
Molecular Weight140.08 g/mol
Exact Mass140.02
IUPAC Name3-(difluoromethylidene)-1,1-difluorocyclobutane
SMILESFC(F)=C1CC(F)(F)C1
InChIInChI=1S/C5H4F4/c6-4(7)3-1-5(8,9)2-3/h1-2H2
InChIKeyXMRDAUYSJKWRRU-UHFFFAOYSA-N
XLogP2.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.08
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1-Difluoro-3-methylene-cyclobutane
CID 13759163
Difluoromethylidenecyclobutane
CID 12859514
1,1-Difluoro-2-methylidenecyclobutane
CID 12859515
1,1-Difluoro-2-methylene-3-(difluoromethylene)cyclobutane
CID 13278483
1,2-Bis(difluoromethylene)cyclobutane
CID 129655252
1,1,2,2-Tetrafluoro-3-methylenecyclobutane
CID 12637091
2-(Difluoromethylidene)-1,1,3,3-tetrafluorocyclobutane
CID 12701525
1,1,3,3-Tetrafluoro-2-methylidenecyclobutane
CID 12859516
2,2-Difluoro-1-(difluoromethylene)cyclobutane
CID 12859517
3-(Difluoromethylidene)-1,1,2,2-tetrafluorocyclobutane
CID 140381903
1,1,5,5,5-Pentafluoro-2-(trifluoromethyl)pent-1-ene
CID 145001257
1,1,2,2-Tetrafluoro-3,4-dimethylidenecyclobutane
CID 71401766

Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethylidene)-1,1-difluorocyclobutane?
The IUPAC name of 3-(difluoromethylidene)-1,1-difluorocyclobutane (CID 12637092) is 3-(difluoromethylidene)-1,1-difluorocyclobutane.
What is the SMILES notation for 3-(difluoromethylidene)-1,1-difluorocyclobutane?
The canonical SMILES for 3-(difluoromethylidene)-1,1-difluorocyclobutane is FC(F)=C1CC(F)(F)C1.
What is the InChIKey of 3-(difluoromethylidene)-1,1-difluorocyclobutane?
The InChIKey is XMRDAUYSJKWRRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4F4/c6-4(7)3-1-5(8,9)2-3/h1-2H2.
What are the key properties of 3-(difluoromethylidene)-1,1-difluorocyclobutane?
3-(difluoromethylidene)-1,1-difluorocyclobutane has a molecular weight of 140.08 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethylidene)-1,1-difluorocyclobutane is sourced from PubChem (CID 12637092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).