copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione

C5H2CuF6O2 — CID 15360935

IUPACcopper;1,1,1,5,5,5-hexafluoropentane-2,4-dione
SMILESO=C(CC(=O)C(F)(F)F)C(F)(F)F.[Cu]
InChIInChI=1S/C5H2F6O2.Cu/c6-4(7,8)2(12)1-3(13)5(9,10)11;/h1H2;
InChIKeyLZPXVVTUQLLOKZ-UHFFFAOYSA-N
MW271.60 g/mol
LogP1.64
Rot. Bonds2

About copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione

copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione (PubChem CID 15360935) has the molecular formula C5H2CuF6O2 and a molecular weight of 271.60 g/mol. Its IUPAC name is copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione.

Molecular Properties

Compound Namecopper;1,1,1,5,5,5-hexafluoropentane-2,4-dione
PubChem CID15360935
Molecular FormulaC5H2CuF6O2
Molecular Weight271.60 g/mol
Exact Mass270.93
IUPAC Namecopper;1,1,1,5,5,5-hexafluoropentane-2,4-dione
SMILESO=C(CC(=O)C(F)(F)F)C(F)(F)F.[Cu]
InChIInChI=1S/C5H2F6O2.Cu/c6-4(7,8)2(12)1-3(13)5(9,10)11;/h1H2;
InChIKeyLZPXVVTUQLLOKZ-UHFFFAOYSA-N
XLogP1.64
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.60
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione?
The IUPAC name of copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione (CID 15360935) is copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione.
What is the SMILES notation for copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione?
The canonical SMILES for copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione is O=C(CC(=O)C(F)(F)F)C(F)(F)F.[Cu].
What is the InChIKey of copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione?
The InChIKey is LZPXVVTUQLLOKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H2F6O2.Cu/c6-4(7,8)2(12)1-3(13)5(9,10)11;/h1H2;.
What are the key properties of copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione?
copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione has a molecular weight of 271.60 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper;1,1,1,5,5,5-hexafluoropentane-2,4-dione is sourced from PubChem (CID 15360935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).