copper bis(2,2,3,3-tetrafluoropropanoate)

C6H2CuF8O4 — CID 160873340

IUPACcopper bis(2,2,3,3-tetrafluoropropanoate)
SMILESO=C([O-])C(F)(F)C(F)F.O=C([O-])C(F)(F)C(F)F.[Cu+2]
InChIInChI=1S/2C3H2F4O2.Cu/c2*4-1(5)3(6,7)2(8)9;/h2*1H,(H,8,9);/q;;+2/p-2
InChIKeySMAXSYNXLFVBSM-UHFFFAOYSA-L
MW353.61 g/mol
LogP-0.73
Rot. Bonds4

About copper bis(2,2,3,3-tetrafluoropropanoate)

copper bis(2,2,3,3-tetrafluoropropanoate) (PubChem CID 160873340) has the molecular formula C6H2CuF8O4 and a molecular weight of 353.61 g/mol. Its IUPAC name is copper bis(2,2,3,3-tetrafluoropropanoate).

Molecular Properties

Compound Namecopper bis(2,2,3,3-tetrafluoropropanoate)
PubChem CID160873340
Molecular FormulaC6H2CuF8O4
Molecular Weight353.61 g/mol
Exact Mass352.91
IUPAC Namecopper bis(2,2,3,3-tetrafluoropropanoate)
SMILESO=C([O-])C(F)(F)C(F)F.O=C([O-])C(F)(F)C(F)F.[Cu+2]
InChIInChI=1S/2C3H2F4O2.Cu/c2*4-1(5)3(6,7)2(8)9;/h2*1H,(H,8,9);/q;;+2/p-2
InChIKeySMAXSYNXLFVBSM-UHFFFAOYSA-L
XLogP-0.73
TPSA80.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.61
LogP ≤ 5-0.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of copper bis(2,2,3,3-tetrafluoropropanoate)?
The IUPAC name of copper bis(2,2,3,3-tetrafluoropropanoate) (CID 160873340) is copper bis(2,2,3,3-tetrafluoropropanoate).
What is the SMILES notation for copper bis(2,2,3,3-tetrafluoropropanoate)?
The canonical SMILES for copper bis(2,2,3,3-tetrafluoropropanoate) is O=C([O-])C(F)(F)C(F)F.O=C([O-])C(F)(F)C(F)F.[Cu+2].
What is the InChIKey of copper bis(2,2,3,3-tetrafluoropropanoate)?
The InChIKey is SMAXSYNXLFVBSM-UHFFFAOYSA-L. The full InChI is InChI=1S/2C3H2F4O2.Cu/c2*4-1(5)3(6,7)2(8)9;/h2*1H,(H,8,9);/q;;+2/p-2.
What are the key properties of copper bis(2,2,3,3-tetrafluoropropanoate)?
copper bis(2,2,3,3-tetrafluoropropanoate) has a molecular weight of 353.61 g/mol, XLogP of -0.73, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(2,2,3,3-tetrafluoropropanoate) is sourced from PubChem (CID 160873340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).