calcium diperchlorate

• ChemBase ID: 109332
• Molecular Formular: CaCl2O8
• Molecular Mass: 238.9792
• Monoisotopic Mass: 237.8596133
• SMILES: [Ca+2].[O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O
• Canonical SMILES: [O-][Cl](=O)(=O)=O.[O-][Cl](=O)(=O)=O.[Ca+2]
• InChI: InChI=1S/Ca.2ClHO4/c;2*2-1(3,4)5/h;2*(H,2,3,4,5)/q+2;;/p-2
• InChIKey: ZQAOXERLHGRFIC-UHFFFAOYSA-L

NAMES AND DATABASE IDS

Names

• IUPAC name: calcium diperchlorate
• IUPAC Traditional name: calcium(2+) diperchlorate ion; calcium diperchlorate
• Synonyms: CALCIUM PERCHLORATE; Calcium perchlorate tetrahydrate; Calcium diperchlorate; Perchloric acid calcium salt (2:1e; Calcium perchlorate; hydrated; Calcium perchlorate hydrate, Reagent Grade; 高氯酸钙水和物, 试剂级

Database IDs

• CAS Number: 13477-36-6
• EC Number: 236-768-0
• MDL Number: MFCD00015971
• PubChem SID: 162095011
• PubChem CID: 61629
• Chemspider ID: 55537
• Wikipedia Title: Calcium_perchlorate

CALCULATED PROPERTIES

• Acid pKa: -6.8919964
• H Acceptors: 4
• H Donor: 0
• LogD (pH = 5.5): -2.4740524
• LogD (pH = 7.4): -2.4740524
• Log P: -0.097653694
• Molar Refractivity: 11.9079 cm^3
• Polarizability: 5.355259 Å^3
• Polar Surface Area: 74.27 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Solubility: 188 g/L (20°C) in water; EtOH, MeOH
• Apperance: Crystalline; White to yellow crystalline solid
• Melting Point: 270°C
• Density: 2.651 g/cm3

Safety Information

• Storage Warning: Hygroscopic
• European Hazard Symbols: Oxidising (O); Irritant (Xi)
• UN Number: UN1455
• Hazard Class: 5.1
• Packing Group: II
• Risk Statements: 8-36/37/38; R:9-18
• Safety Statements: 17-26-37-60; R; S:13-16-27
• TSCA Listed: 是
• DOT Hazard: Oxidizer
• GHS Pictograms: GHS03; GHS07
• Eye Hazard: Avoid contact with eyes. In case of contact, rinse immediately with plenty of water and seek medical advice
• Skin Hazard: Avoid contact with skin. In case of contact, rinse immediately with (manufacturer's instructions)
• Main Hazard: Inhalation, ingestion or contact (skin, eyes) with vapors or substance may cause severe injury, burns or death. Fire may produce irritating, corrosive and/or toxic gases. Runoff from fire control or dilution water may cause pollution.
• NFPA704:
  

  B

  XI

  B

  OX
• GHS Hazard statements: H272-H315-H319-H335
• GHS Precautionary statements: P221-P210-P305+P351+P338-P302+P352-P405-P501A