calcium selenite

• ChemBase ID: 106897
• Molecular Formular: CaO3Se
• Molecular Mass: 167.0362
• Monoisotopic Mass: 167.86385584
• SMILES: [Ca+2].[O-][Se](=O)[O-]
• Canonical SMILES: [O-][Se](=O)[O-].[Ca+2]
• InChI: InChI=1S/Ca.H2O3Se/c;1-4(2)3/h;(H2,1,2,3)/q+2;/p-2
• InChIKey: UWZXJRBXKTZILP-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: calcium selenite
• IUPAC Traditional name: calcium(2+) selenit
• Synonyms: CALCIUM SELENITE

Database IDs

• CAS Number: 13780-18-2
• EC Number: 237-427-9
• PubChem SID: 162093355
• PubChem CID: 159696

CALCULATED PROPERTIES

• Acid pKa: 11.928732
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -1.2765001
• LogD (pH = 7.4): -1.2765127
• Log P: -1.2765
• Molar Refractivity: 17.4436 cm^3
• Polarizability: 3.671146 Å^3
• Polar Surface Area: 63.19 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• European Hazard Symbols: Toxic (T)
• Risk Statements: R:23/25-33
• Safety Statements: S:28-45-20/21

DETAILS

MP Biomedicals - 05201797

MP Biomedicals Rare Chemical collection