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10326-27-9 molecular structure
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dichlorobarium dihydrate

ChemBase ID: 130832
Molecular Formular: BaCl2H4O2
Molecular Mass: 244.26356
Monoisotopic Mass: 243.86408173
SMILES and InChIs

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

Cite this record

CBID:130832 http://www.chembase.cn/molecule-130832.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dichlorobarium dihydrate
IUPAC Traditional name
dichlorobarium dihydrate
Synonyms
Barium chloride dihydrate
氯化钡 二水合物
CAS Number
10326-27-9
EC Number
233-788-1
MDL Number
MFCD00149154
PubChem SID
24858504
24853018
24877692
24891531
162225110
PubChem CID
25157

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.069  LogD (pH = 7.4) 1.069 
Log P 1.069  Molar Refractivity 12.2726 cm3
Polarizability 10.446077 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
powder expand Show data source
pH
5.0-8.0 (25 °C, 50 mg/mL in H2O) expand Show data source
5.2-8.0 (25 °C, 5%) expand Show data source
5.2-8.2 (25 °C, 5%) expand Show data source
5.2-8.2 (25 °C, 50 mg/mL in H2O) expand Show data source
5-7 (20 °C, 5%) expand Show data source
RTECS
CQ8751000 expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
UN Number
1564 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
20-25 expand Show data source
Safety Statements
45 expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301-H332 expand Show data source
GHS Precautionary statements
P301 + P310 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 1564 6.1/PG 3 expand Show data source
Purity
≥98.5% expand Show data source
≥99% expand Show data source
≥99.0% expand Show data source
≥99.0% (KT) expand Show data source
≥99.999% trace metals basis expand Show data source
Grade
ACS reagent expand Show data source
ACS reagent, reag. ISO, reag. Ph. Eur. expand Show data source
JIS special grade expand Show data source
puriss. expand Show data source
puriss. p.a. expand Show data source
puriss. p.a. plus expand Show data source
purum p.a. expand Show data source
SAJ first grade expand Show data source
Impurities
≤0.0005% heavy metals (as Pb) expand Show data source
≤0.002% heavy metals (as Pb) expand Show data source
≤0.002% total nitrogen (N) expand Show data source
≤0.005% insolubles expand Show data source
≤0.005% oxidizers expand Show data source
Cation Traces
Ca: ≤0.05% expand Show data source
Ca: ≤200 mg/kg expand Show data source
Ca: ≤50 mg/kg expand Show data source
Ca: ≤500 mg/kg expand Show data source
Cd: ≤5 mg/kg expand Show data source
Cd: ≤50 mg/kg expand Show data source
Co: ≤5 mg/kg expand Show data source
Co: ≤50 mg/kg expand Show data source
Cr: ≤5 mg/kg expand Show data source
Cu: ≤5 mg/kg expand Show data source
Cu: ≤50 mg/kg expand Show data source
Fe: ≤1 mg/kg expand Show data source
Fe: ≤10 mg/kg expand Show data source
Fe: ≤2 ppm expand Show data source
Fe: ≤50 mg/kg expand Show data source
heavy metals (as Pb): ≤5 ppm expand Show data source
K: ≤0.0025% expand Show data source
K: ≤100 mg/kg expand Show data source
K: ≤25 mg/kg expand Show data source
K: ≤500 mg/kg expand Show data source
Mg: ≤10 mg/kg expand Show data source
Mg: ≤20 mg/kg expand Show data source
Mg: ≤5 mg/kg expand Show data source
Mn: ≤5 mg/kg expand Show data source
Na: ≤0.005% expand Show data source
Na: ≤1000 mg/kg expand Show data source
Na: ≤200 mg/kg expand Show data source
Na: ≤50 mg/kg expand Show data source
Ni: ≤5 mg/kg expand Show data source
Ni: ≤50 mg/kg expand Show data source
Pb: ≤5 mg/kg expand Show data source
Pb: ≤50 mg/kg expand Show data source
Sr: ≤0.1% expand Show data source
Sr: ≤100 mg/kg expand Show data source
Sr: ≤1000 mg/kg expand Show data source
Sr: ≤5000 mg/kg expand Show data source
Zn: ≤5 mg/kg expand Show data source
Zn: ≤50 mg/kg expand Show data source
Loss on Drying
14.0-16.0% loss on drying expand Show data source
14.0-16.0% loss on drying, 150 °C expand Show data source
Empirical Formula (Hill Notation)
BaCl2 · 2H2O expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 529591 external link
Packaging
100 g in poly bottle
Sigma Aldrich - 217565 external link
Packaging
100, 500 g in poly bottle
2.5 kg in poly bottle
Sigma Aldrich - B0750 external link
包装
1 kg in poly bottle
100, 500 g in poly bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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