copper(2+) ion oxalate

• ChemBase ID: 295358
• Molecular Formular: C2CuO4
• Molecular Mass: 151.565
• Monoisotopic Mass: 150.90925598
• SMILES: C(=O)(C(=O)[O-])[O-].[Cu+2]
• Canonical SMILES: [O-]C(=O)C(=O)[O-].[Cu+2]
• InChI: InChI=1S/C2H2O4.Cu/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2
• InChIKey: QYCVHILLJSYYBD-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: copper(2+) ion oxalate
• IUPAC Traditional name: copper(2+) ion oxalate
• Synonyms: Cupric oxalate; Copper(II) oxalate hemihydrate; 草酸铜(II)半水合物

Database IDs

• CAS Number: 5893-66-3
• EC Number: 212-411-4
• MDL Number: MFCD00150451
• Merck Index: 142645
• PubChem SID: 180680889
• PubChem CID: 13148

CALCULATED PROPERTIES

• Acid pKa: 1.3639908
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.101814
• LogD (pH = 7.4): -6.8848467
• Log P: -0.26375157
• Molar Refractivity: 36.1128 cm^3
• Polarizability: 5.6277657 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 1
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Soluble in NH4OH

Safety Information

• European Hazard Symbols: X
• UN Number: UN3288
• Hazard Class: 6.1
• Packing Group: III
• Risk Statements: 21/22
• Safety Statements: 24/25
• TSCA Listed: 是
• GHS Pictograms: GHS07
• GHS Hazard statements: H302-H312
• GHS Precautionary statements: P280-P302+P352-P322-P301+P312-P312-P501A

Product Information

• Purity: 98%