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13477-36-6 molecular structure
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calcium diperchlorate

ChemBase ID: 109332
Molecular Formular: CaCl2O8
Molecular Mass: 238.9792
Monoisotopic Mass: 237.8596133
SMILES and InChIs

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

Cite this record

CBID:109332 http://www.chembase.cn/molecule-109332.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
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
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

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -6.8919964  H Acceptors
H Donor LogD (pH = 5.5) -2.4740524 
LogD (pH = 7.4) -2.4740524  Log P -0.097653694 
Molar Refractivity 11.9079 cm3 Polarizability 5.355259 Å3
Polar Surface Area 74.27 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
188 g/L (20°C) in water expand Show data source
EtOH, MeOH expand Show data source
Apperance
Crystalline expand Show data source
White to yellow crystalline solid expand Show data source
Melting Point
270°C expand Show data source
Density
2.651 g/cm3 expand Show data source
Storage Warning
Hygroscopic expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
Irritant Irritant (Xi) expand Show data source
UN Number
UN1455 expand Show data source
MSDS Link
Download expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
II expand Show data source
Risk Statements
8-36/37/38 expand Show data source
R:9-18 expand Show data source
Safety Statements
17-26-37-60 expand Show data source
R expand Show data source
S:13-16-27 expand Show data source
TSCA Listed
expand Show data source
DOT Hazard
Oxidizer expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS07 expand Show data source
Eye Hazard
Avoid contact with eyes. In case of contact, rinse immediately with plenty of water and seek medical advice expand Show data source
Skin Hazard
Avoid contact with skin. In case of contact, rinse immediately with (manufacturer's instructions) expand Show data source
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. expand Show data source
NFPA704
NFPA 704 diagram
B
XI
B
OX
expand Show data source
GHS Hazard statements
H272-H315-H319-H335 expand Show data source
GHS Precautionary statements
P221-P210-P305+P351+P338-P302+P352-P405-P501A expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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