calcium;copper;difluoride

CaCuF2 — CID 174267360

IUPACcalcium;copper;difluoride
SMILES[Ca+2].[Cu].[F-].[F-]
InChIInChI=1S/Ca.Cu.2FH/h;;2*1H/q+2;;;/p-2
InChIKeyXVMMYTQCPIOMLF-UHFFFAOYSA-L
MW141.62 g/mol
LogP-6.38
Rot. Bonds

About calcium;copper;difluoride

calcium;copper;difluoride (PubChem CID 174267360) has the molecular formula CaCuF2 and a molecular weight of 141.62 g/mol. Its IUPAC name is calcium;copper;difluoride.

Molecular Properties

Compound Namecalcium;copper;difluoride
PubChem CID174267360
Molecular FormulaCaCuF2
Molecular Weight141.62 g/mol
Exact Mass140.89
IUPAC Namecalcium;copper;difluoride
SMILES[Ca+2].[Cu].[F-].[F-]
InChIInChI=1S/Ca.Cu.2FH/h;;2*1H/q+2;;;/p-2
InChIKeyXVMMYTQCPIOMLF-UHFFFAOYSA-L
XLogP-6.38
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.62
LogP ≤ 5-6.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of calcium;copper;difluoride?
The IUPAC name of calcium;copper;difluoride (CID 174267360) is calcium;copper;difluoride.
What is the SMILES notation for calcium;copper;difluoride?
The canonical SMILES for calcium;copper;difluoride is [Ca+2].[Cu].[F-].[F-].
What is the InChIKey of calcium;copper;difluoride?
The InChIKey is XVMMYTQCPIOMLF-UHFFFAOYSA-L. The full InChI is InChI=1S/Ca.Cu.2FH/h;;2*1H/q+2;;;/p-2.
What are the key properties of calcium;copper;difluoride?
calcium;copper;difluoride has a molecular weight of 141.62 g/mol, XLogP of -6.38, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for calcium;copper;difluoride is sourced from PubChem (CID 174267360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).