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13255-26-0 molecular structure
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barium(2+) ion oxosilanebis(olate)

ChemBase ID: 137559
Molecular Formular: BaO3Si
Molecular Mass: 213.4107
Monoisotopic Mass: 213.86691739
SMILES and InChIs

SMILES:
[O-][Si](=O)[O-].[Ba+2]
Canonical SMILES:
[O-][Si](=O)[O-].[Ba+2]
InChI:
InChI=1S/Ba.O3Si/c;1-4(2)3/q+2;-2
InChIKey:
HMOQPOVBDRFNIU-UHFFFAOYSA-N

Cite this record

CBID:137559 http://www.chembase.cn/molecule-137559.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
barium(2+) ion oxosilanebis(olate)
IUPAC Traditional name
barium(2+) ion oxosilanebis(olate)
Synonyms
Barium metasilicate
硅酸钡
CAS Number
13255-26-0
EC Number
236-245-7
MDL Number
MFCD00014186
PubChem SID
24873985
162231821
PubChem CID
166725

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
517917 external link Add to cart Please log in.
Data Source Data ID
PubChem 166725 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 2.69897  H Acceptors
H Donor LogD (pH = 5.5) -3.533295 
LogD (pH = 7.4) -3.6921096  Log P -1.3788 
Molar Refractivity 4.3287 cm3 Polarizability 4.5841517 Å3
Polar Surface Area 63.19 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Harmful Harmful (Xn) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
1 expand Show data source
Risk Statements
20/22 expand Show data source
Safety Statements
28.1 expand Show data source
Loss on Drying
≤10% loss on ignition expand Show data source
Linear Formula
BaSiO3 expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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