beryllium(2+) ion hydrogen phosphate

• ChemBase ID: 106744
• Molecular Formular: BeHO4P
• Molecular Mass: 104.991483
• Monoisotopic Mass: 104.97342734
• SMILES: [Be+2].OP(=O)([O-])[O-]
• Canonical SMILES: [O-]P(=O)(O)[O-].[Be+2]
• InChI: InChI=1S/Be.H3O4P/c;1-5(2,3)4/h;(H3,1,2,3,4)/q+2;/p-2
• InChIKey: XUYHBCPJXPJTCK-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: beryllium(2+) ion hydrogen phosphate
• IUPAC Traditional name: beryllium(2+) hydrogen phosphate
• Synonyms: BERYLLIUM PHOSPHATE

Database IDs

• CAS Number: 13598-15-7
• PubChem SID: 162089039
• PubChem CID: 26127

CALCULATED PROPERTIES

• Acid pKa: 1.7961261
• H Acceptors: 4
• H Donor: 1
• LogD (pH = 5.5): -3.3916447
• LogD (pH = 7.4): -3.9718332
• Log P: -1.0201038
• Molar Refractivity: 12.4085 cm^3
• Polarizability: 5.685633 Å^3
• Polar Surface Area: 83.42 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Safety Information

• RTECS: DS2975000
• European Hazard Symbols: Highly toxic (T+)
• Risk Statements: R:25-26-36/37/38-43-48/23-49
• Safety Statements: S:45-53

DETAILS

MP Biomedicals - 05201280

MP Biomedicals Rare Chemical collection