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10035-04-8 molecular structure
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calcium dihydrate dichloride

ChemBase ID: 105824
Molecular Formular: CaCl2O2
Molecular Mass: 142.9828
Monoisotopic Mass: 141.89012558
SMILES and InChIs

SMILES:
O.O.[Cl-].[Cl-].[Ca+2]
Canonical SMILES:
O.O.[Cl-].[Cl-].[Ca+2]
InChI:
InChI=1S/Ca.2ClH.2H2O/h;2*1H;2*1H2/q+2;;;;/p-2
InChIKey:
LLSDKQJKOVVTOJ-UHFFFAOYSA-L

Cite this record

CBID:105824 http://www.chembase.cn/molecule-105824.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
calcium dihydrate dichloride
IUPAC Traditional name
calcium(2+) dihydrate dichloride
calcium dihydrate dichloride
Synonyms
Calcium chloride dihydrate, ACS
CALCIUM CHLORIDE DIHYDRATE
CALCIUM CHLORIDE DIHYDRATE, ACS
CALCIUM CHLORIDE DIHYDRATE, USP
Calcium chloride dihydrate
二水合氯化钙, ACS
二水合氯化钙
CAS Number
10035-04-8
EC Number
233-140-8
MDL Number
MFCD00149613
Merck Index
141659
PubChem SID
162088987
PubChem CID
6093260

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 15.7  H Acceptors
H Donor LogD (pH = 5.5) -0.652 
LogD (pH = 7.4) -0.652  Log P -0.652 
Molar Refractivity 3.7 cm3 Polarizability 1.4714895 Å3
Polar Surface Area 25.3 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Granular expand Show data source
Powder expand Show data source
Density
0.835 expand Show data source
Storage Condition
Room Temperature (15-30°C), Desiccate expand Show data source
Storage Warning
Hygroscopic expand Show data source
RTECS
EV9810000 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
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Risk Statements
36 expand Show data source
R:36/37/38 expand Show data source
Safety Statements
22-24 expand Show data source
S:20-25-26-37/39 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H319 expand Show data source
GHS Precautionary statements
P280-P264-P305+P351+P338-P337+P313 expand Show data source
Purity
~99% expand Show data source
99% min expand Show data source
99.0-105.0% expand Show data source
Grade
ACS expand Show data source
USP expand Show data source
Certificate of Analysis
Download expand Show data source
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DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 02194635 external link
Cell Culture Reagent
Dihydrate
Purity: ~99%
MP Biomedicals - 02199524 external link
White Granules
MP Biomedicals - 02194815 external link
Molecular Biology Reagent
Purity: ~99%
Dihydrate
MP Biomedicals - 02195088 external link
Dihydrate
Purity: ~99%

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
  • • Sambrook, J., et al., Molecular Cloning: A Laboratory Manual, Cold Spring Harbor Laboratory,
  • • 82-1.84, (1989).
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PATENTS

PATENTS

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INTERNET

INTERNET

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