butanoic acid;copper

C8H16CuO4 — CID 57425269

IUPACbutanoic acid;copper
SMILESCCCC(=O)O.CCCC(=O)O.[Cu]
InChIInChI=1S/2C4H8O2.Cu/c2*1-2-3-4(5)6;/h2*2-3H2,1H3,(H,5,6);
InChIKeyDQUGBBVYNXCKTI-UHFFFAOYSA-N
MW239.76 g/mol
LogP1.74
Rot. Bonds4

About butanoic acid;copper

butanoic acid;copper (PubChem CID 57425269) has the molecular formula C8H16CuO4 and a molecular weight of 239.76 g/mol. Its IUPAC name is butanoic acid;copper.

Molecular Properties

Compound Namebutanoic acid;copper
PubChem CID57425269
Molecular FormulaC8H16CuO4
Molecular Weight239.76 g/mol
Exact Mass239.03
IUPAC Namebutanoic acid;copper
SMILESCCCC(=O)O.CCCC(=O)O.[Cu]
InChIInChI=1S/2C4H8O2.Cu/c2*1-2-3-4(5)6;/h2*2-3H2,1H3,(H,5,6);
InChIKeyDQUGBBVYNXCKTI-UHFFFAOYSA-N
XLogP1.74
TPSA74.60 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.76
LogP ≤ 51.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of butanoic acid;copper?
The IUPAC name of butanoic acid;copper (CID 57425269) is butanoic acid;copper.
What is the SMILES notation for butanoic acid;copper?
The canonical SMILES for butanoic acid;copper is CCCC(=O)O.CCCC(=O)O.[Cu].
What is the InChIKey of butanoic acid;copper?
The InChIKey is DQUGBBVYNXCKTI-UHFFFAOYSA-N. The full InChI is InChI=1S/2C4H8O2.Cu/c2*1-2-3-4(5)6;/h2*2-3H2,1H3,(H,5,6);.
What are the key properties of butanoic acid;copper?
butanoic acid;copper has a molecular weight of 239.76 g/mol, XLogP of 1.74, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for butanoic acid;copper is sourced from PubChem (CID 57425269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).