bis($l^{1}-copper(1+) ion) sulfite

• ChemBase ID: 108130
• Molecular Formular: Cu2O3S
• Molecular Mass: 207.1552
• Monoisotopic Mass: 205.81600986
• SMILES: [Cu+].[Cu+].[O-]S(=O)[O-]
• Canonical SMILES: [O-]S(=O)[O-].[Cu+].[Cu+]
• InChI: InChI=1S/2Cu.H2O3S/c;;1-4(2)3/h;;(H2,1,2,3)/q2*+1;/p-2
• InChIKey: RPJAQOVNRDOGAY-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: bis($l^{1}-copper(1+) ion) sulfite
• IUPAC Traditional name: dicopper(1+) sulfite
• Synonyms: CUPROUS SULFITE

Database IDs

• CAS Number: 35788-00-2
• PubChem SID: 162095116
• PubChem CID: 169714

CALCULATED PROPERTIES

• Acid pKa: -3.669346
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -3.4606745
• LogD (pH = 7.4): -3.4734561
• Log P: -1.1546873
• Molar Refractivity: 10.0845 cm^3
• Polarizability: 5.3231616 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

DETAILS

MP Biomedicals - 05206146

MP Biomedicals Rare Chemical collection