copper bis(4-oxopentanoate)

C10H14CuO6 — CID 86599724

IUPACcopper bis(4-oxopentanoate)
SMILESCC(=O)CCC(=O)[O-].CC(=O)CCC(=O)[O-].[Cu+2]
InChIInChI=1S/2C5H8O3.Cu/c2*1-4(6)2-3-5(7)8;/h2*2-3H2,1H3,(H,7,8);/q;;+2/p-2
InChIKeySKZVZJFDEFVSLM-UHFFFAOYSA-L
MW293.76 g/mol
LogP-1.79
Rot. Bonds6

About copper bis(4-oxopentanoate)

copper bis(4-oxopentanoate) (PubChem CID 86599724) has the molecular formula C10H14CuO6 and a molecular weight of 293.76 g/mol. Its IUPAC name is copper bis(4-oxopentanoate).

Molecular Properties

Compound Namecopper bis(4-oxopentanoate)
PubChem CID86599724
Molecular FormulaC10H14CuO6
Molecular Weight293.76 g/mol
Exact Mass293.01
IUPAC Namecopper bis(4-oxopentanoate)
SMILESCC(=O)CCC(=O)[O-].CC(=O)CCC(=O)[O-].[Cu+2]
InChIInChI=1S/2C5H8O3.Cu/c2*1-4(6)2-3-5(7)8;/h2*2-3H2,1H3,(H,7,8);/q;;+2/p-2
InChIKeySKZVZJFDEFVSLM-UHFFFAOYSA-L
XLogP-1.79
TPSA114.40 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.76
LogP ≤ 5-1.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

tris(4-oxopentanoate);vanadium
CID 157360073
dioxouranium(2+);bis(4-oxopentanoate)
CID 122625269
formaldehyde;tris(4-oxopentanoate);rhodium(3+)
CID 22251172
sodium;4-oxopentanoate;4-oxopentanoic acid
CID 159759335
4-oxopentanoate;pentanoate
CID 21431295
copper;zinc;bis(butanedioate)
CID 159835693
hexane-2,5-dione
CID 8035
disodium;acetic acid;butanedioate
CID 173373024
2-hydroxyethyl(trimethyl)azanium;4-oxopentanoate
CID 87096007
disodium;butanedioate;methanol
CID 160588999
bis(butanedioate);osmium(4+)
CID 159559487
dicopper diacetate
CID 158276690

Frequently Asked Questions

What is the IUPAC name of copper bis(4-oxopentanoate)?
The IUPAC name of copper bis(4-oxopentanoate) (CID 86599724) is copper bis(4-oxopentanoate).
What is the SMILES notation for copper bis(4-oxopentanoate)?
The canonical SMILES for copper bis(4-oxopentanoate) is CC(=O)CCC(=O)[O-].CC(=O)CCC(=O)[O-].[Cu+2].
What is the InChIKey of copper bis(4-oxopentanoate)?
The InChIKey is SKZVZJFDEFVSLM-UHFFFAOYSA-L. The full InChI is InChI=1S/2C5H8O3.Cu/c2*1-4(6)2-3-5(7)8;/h2*2-3H2,1H3,(H,7,8);/q;;+2/p-2.
What are the key properties of copper bis(4-oxopentanoate)?
copper bis(4-oxopentanoate) has a molecular weight of 293.76 g/mol, XLogP of -1.79, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(4-oxopentanoate) is sourced from PubChem (CID 86599724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).