beryllium(2+) ion sulfate

• ChemBase ID: 126117
• Molecular Formular: BeO4S
• Molecular Mass: 105.074782
• Monoisotopic Mass: 104.96391168
• SMILES: [Be+2].[O-]S(=O)(=O)[O-]
• Canonical SMILES: [O-]S(=O)(=O)[O-].[Be+2]
• InChI: InChI=1S/Be.H2O4S/c;1-5(2,3)4/h;(H2,1,2,3,4)/q+2;/p-2
• InChIKey: KQHXBDOEECKORE-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: beryllium(2+) ion sulfate
• IUPAC Traditional name: beryllium(2+) ion sulfate
• Synonyms: Beryllium sulfate

Database IDs

• CAS Number: 13510-49-1
• EC Number: 236-842-2
• PubChem SID: 162220458
• PubChem CID: 26077
• CHEBI ID: 53473
• Chemspider ID: 24291
• Wikipedia Title: Beryllium_sulfate

CALCULATED PROPERTIES

• Acid pKa: -3.034349
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -5.569452
• LogD (pH = 7.4): -5.594027
• Log P: -0.841552
• Molar Refractivity: 11.5274 cm^3
• Polarizability: 6.037845 Å^3
• Polar Surface Area: 80.26 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: 30.5 g/100 mL (30 °C) in water; insoluble in alcohol
• Apperance: white solid
• Melting Point: 110 °C (tetrahydrate, -2H₂O); 400 °C (dihydrate, dehydr.); 550–600 decomp.
• Boiling Point: 2500 °C (anhydrate) ; 580 °C (tetrahydrate)
• Flash Point: non-flammable
• Density: 2.50 g/cm^3 (anhydrous); 1.71 g/cm^3 (tetrahydrate)
• Refractive Index: 1.4374 (tetrahydrate)
• Odor: odorless

Safety Information

• RTECS: DS4800000
• European Hazard Symbols: Carc. Cat. 2; Dangerous for the environment (N); Very toxic (T+)
• Risk Statements: R49, R25, R26, R36/37/38, R43, R48/23, R51/53
• Safety Statements: S53, S45
• EU Index: 004-002-00-2
• GHS Pictograms: : Acute Tox. 2; : Carc. 1B; : Aquatic Chronic 2
• GHS Signal Word: DANGER
• LD50: 82 mg/kg
• GHS Hazard statements: 350, 330, 301, 372, 319, 335, 315, 317, 411