oxalic acid copper

• ChemBase ID: 107196
• Molecular Formular: C2H2CuO4
• Molecular Mass: 153.58088
• Monoisotopic Mass: 152.92490604
• SMILES: [Cu].OC(=O)C(=O)O
• Canonical SMILES: OC(=O)C(=O)O.[Cu]
• InChI: InChI=1S/C2H2O4.Cu/c3-1(4)2(5)6;/h(H,3,4)(H,5,6)
• InChIKey: NTKHLGAMTDSVMO-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: oxalic acid copper
• IUPAC Traditional name: oxalic acid copper
• Synonyms: COPPER OXALATE

Database IDs

• CAS Number: 23087-58-3
• PubChem SID: 162094581
• PubChem CID: 24189220

CALCULATED PROPERTIES

• Acid pKa: 1.3639908
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -5.101814
• LogD (pH = 7.4): -6.8848467
• Log P: -0.26375157
• Molar Refractivity: 14.4386 cm^3
• Polarizability: 5.8697963 Å^3
• Polar Surface Area: 74.6 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true