calcium hydrate diiodate

• ChemBase ID: 303479
• Molecular Formular: CaH2I2O7
• Molecular Mass: 407.89862
• Monoisotopic Mass: 407.75158938
• SMILES: [O-][I](=O)=O.[O-][I](=O)=O.[Ca+2].O
• Canonical SMILES: [O-][I](=O)=O.[O-][I](=O)=O.O.[Ca+2]
• InChI: InChI=1S/Ca.2HIO3.H2O/c;2*2-1(3)4;/h;2*(H,2,3,4);1H2/q+2;;;/p-2
• InChIKey: LHJRUHLVRPQAJF-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: calcium hydrate diiodate
• IUPAC Traditional name: calcium hydrate diiodate
• Synonyms: Calcium iodate monohydrate; 碘酸钙单水和物, 99+%最低

Database IDs

• CAS Number: 10031-32-0
• EC Number: 232-191-3
• MDL Number: MFCD00036265
• Merck Index: 141676

CALCULATED PROPERTIES

• Acid pKa: -32.990604
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -2.1981263
• LogD (pH = 7.4): -2.1981263
• Log P: 0.17827241
• Molar Refractivity: 17.6695 cm^3
• Polarizability: 8.199112 Å^3
• Polar Surface Area: 57.2 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: Slightly soluble in water
• Apperance: Powder

Safety Information

• European Hazard Symbols: Oxidising (O); Irritant (Xi)
• UN Number: UN1479
• Hazard Class: 5.1
• Packing Group: II
• Risk Statements: 8-36/37/38
• Safety Statements: 17-26
• TSCA Listed: 是
• GHS Pictograms: GHS03; GHS07
• GHS Hazard statements: H272-H315-H319-H335
• GHS Precautionary statements: P221-P210-P305+P351+P338-P302+P352-P405-P501A

Product Information

• Purity: 99+%