strontium(2+) ion diacetate

• ChemBase ID: 112067
• Molecular Formular: C4H6O4Sr
• Molecular Mass: 205.70804
• Monoisotopic Mass: 205.93222067
• SMILES: [Sr+2].CC(=O)[O-].CC(=O)[O-]
• Canonical SMILES: [O-]C(=O)C.[O-]C(=O)C.[Sr+2]
• InChI: InChI=1S/2C2H4O2.Sr/c2*1-2(3)4;/h2*1H3,(H,3,4);/q;;+2/p-2
• InChIKey: RXSHXLOMRZJCLB-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: strontium(2+) ion diacetate
• IUPAC Traditional name: strontium(2+) bis(acetate ion); strontium(2+) ion diacetate
• Synonyms: STRONTIUM ACETATE; Strontium acetate hydrate, Puratronic®; 乙酸锶水合物, Puratronic®

Database IDs

• CAS Number: 543-94-2
• EC Number: 208-854-8
• MDL Number: MFCD00036392
• Beilstein Number: 3692534
• Merck Index: 148836
• PubChem SID: 162097154
• PubChem CID: 10987

CALCULATED PROPERTIES

• Acid pKa: 4.54344
• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): -1.2242727
• LogD (pH = 7.4): -2.9968748
• Log P: -0.22334571
• Molar Refractivity: 23.4808 cm^3
• Polarizability: 4.912116 Å^3
• Polar Surface Area: 40.13 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Crystalline
• Melting Point: 150°C -0.5H{2}O
• Density: 2.1 g/ml

Safety Information

• Storage Warning: Hygroscopic
• RTECS: AJ4725000
• TSCA Listed: 是

Product Information

• Purity: 99.9965% (metals basis)