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14518-94-6 molecular structure
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cadmium(2+) ion dibromate

ChemBase ID: 112440
Molecular Formular: Br2CdO6
Molecular Mass: 368.2154
Monoisotopic Mass: 367.70951972
SMILES and InChIs

SMILES:
[Cd+2].[O-][Br](=O)=O.[O-][Br](=O)=O
Canonical SMILES:
[O-][Br](=O)=O.[O-][Br](=O)=O.[Cd+2]
InChI:
InChI=1S/2BrHO3.Cd/c2*2-1(3)4;/h2*(H,2,3,4);/q;;+2/p-2
InChIKey:
VECQEXBULIKSDM-UHFFFAOYSA-L

Cite this record

CBID:112440 http://www.chembase.cn/molecule-112440.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
cadmium(2+) ion dibromate
IUPAC Traditional name
cadmium(2+) dibromate
cadmium(2+) ion dibromate
Synonyms
CADMIUM BROMATE
Cadmium bromate hydrate
溴酸镉水合物
CAS Number
14518-94-6
MDL Number
MFCD00015991
PubChem SID
162097378
PubChem CID
14598111

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 14598111 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -29.820747  H Acceptors
H Donor LogD (pH = 5.5) -2.1853838 
LogD (pH = 7.4) -2.1853838  Log P 0.19101496 
Molar Refractivity 13.0639 cm3 Polarizability 5.874396 Å3
Polar Surface Area 57.2 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Oxidising Oxidising (O) expand Show data source
X expand Show data source
UN Number
UN1450 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
8-20/21/22-50/53 expand Show data source
Safety Statements
9-17-36/37-57-60 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS07 expand Show data source
GHS09 expand Show data source
GHS Hazard statements
H272-H400-H410-H302-H312-H332 expand Show data source
GHS Precautionary statements
P221-P210-P220-P261-P302+P352-P501A expand Show data source
Purity
98% expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05223949 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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