copper;difluoromethanesulfonic acid

CH2CuF2O3S — CID 174361368

IUPACcopper;difluoromethanesulfonic acid
SMILESO=S(=O)(O)C(F)F.[Cu]
InChIInChI=1S/CH2F2O3S.Cu/c2-1(3)7(4,5)6;/h1H,(H,4,5,6);
InChIKeyCDASFMGUAIVVRU-UHFFFAOYSA-N
MW195.63 g/mol
LogP0.09
Rot. Bonds1

About copper;difluoromethanesulfonic acid

copper;difluoromethanesulfonic acid (PubChem CID 174361368) has the molecular formula CH2CuF2O3S and a molecular weight of 195.63 g/mol. Its IUPAC name is copper;difluoromethanesulfonic acid.

Molecular Properties

Compound Namecopper;difluoromethanesulfonic acid
PubChem CID174361368
Molecular FormulaCH2CuF2O3S
Molecular Weight195.63 g/mol
Exact Mass194.90
IUPAC Namecopper;difluoromethanesulfonic acid
SMILESO=S(=O)(O)C(F)F.[Cu]
InChIInChI=1S/CH2F2O3S.Cu/c2-1(3)7(4,5)6;/h1H,(H,4,5,6);
InChIKeyCDASFMGUAIVVRU-UHFFFAOYSA-N
XLogP0.09
TPSA54.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.63
LogP ≤ 50.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Sulfonic_acid_2', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of copper;difluoromethanesulfonic acid?
The IUPAC name of copper;difluoromethanesulfonic acid (CID 174361368) is copper;difluoromethanesulfonic acid.
What is the SMILES notation for copper;difluoromethanesulfonic acid?
The canonical SMILES for copper;difluoromethanesulfonic acid is O=S(=O)(O)C(F)F.[Cu].
What is the InChIKey of copper;difluoromethanesulfonic acid?
The InChIKey is CDASFMGUAIVVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/CH2F2O3S.Cu/c2-1(3)7(4,5)6;/h1H,(H,4,5,6);.
What are the key properties of copper;difluoromethanesulfonic acid?
copper;difluoromethanesulfonic acid has a molecular weight of 195.63 g/mol, XLogP of 0.09, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;difluoromethanesulfonic acid is sourced from PubChem (CID 174361368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).