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814-95-9 molecular structure
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strontium(2+) ion oxalate

ChemBase ID: 129632
Molecular Formular: C2O4Sr
Molecular Mass: 175.639
Monoisotopic Mass: 175.88527048
SMILES and InChIs

SMILES:
[Sr+2].[O-]C(=O)C(=O)[O-]
Canonical SMILES:
[O-]C(=O)C(=O)[O-].[Sr+2]
InChI:
InChI=1S/C2H2O4.Sr/c3-1(4)2(5)6;/h(H,3,4)(H,5,6);/q;+2/p-2
InChIKey:
KQAGKTURZUKUCH-UHFFFAOYSA-L

Cite this record

CBID:129632 http://www.chembase.cn/molecule-129632.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
strontium(2+) ion oxalate
IUPAC Traditional name
strontium(2+) ion oxalate
Synonyms
Strontium oxalate
Strontium oxalate
草酸锶
CAS Number
814-95-9
EC Number
212-415-6
MDL Number
MFCD00050803
PubChem SID
162223922
PubChem CID
69947
Chemspider ID
63140
Wikipedia Title
Strontium_oxalate

DATA SOURCES

DATA SOURCES

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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 1.3639908  H Acceptors
H Donor LogD (pH = 5.5) -5.101814 
LogD (pH = 7.4) -6.8848467  Log P -0.26375157 
Molar Refractivity 36.1128 cm3 Polarizability 5.6277657 Å3
Polar Surface Area 80.26 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
Insoluble in water expand Show data source
Soluble in hydrochloric acid and nitric acid expand Show data source
Apperance
Powder/lump expand Show data source
Boiling Point
Decomposes above 200°C expand Show data source
Density
2.08 g/cm3 expand Show data source
European Hazard Symbols
X expand Show data source
UN Number
UN3288 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
III expand Show data source
Risk Statements
21/22 expand Show data source
Safety Statements
24/25 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
Main Hazard
Skin and eye irritant. Inhaling the compound will irritate mucus membrane in the lungs. expand Show data source
NFPA704
NFPA 704 diagram
0
1
1
E
expand Show data source
GHS Hazard statements
H302-H312 expand Show data source
GHS Precautionary statements
P280-P302+P352-P322-P301+P312-P312-P501A expand Show data source
Purity
95% 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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