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7789-38-0 molecular structure
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sodium bromate

ChemBase ID: 129510
Molecular Formular: BrNaO3
Molecular Mass: 150.89197
Monoisotopic Mass: 149.89285014
SMILES and InChIs

SMILES:
[Na+].[O-][Br](=O)=O
Canonical SMILES:
[O-][Br](=O)=O.[Na+]
InChI:
InChI=1S/BrHO3.Na/c2-1(3)4;/h(H,2,3,4);/q;+1/p-1
InChIKey:
XUXNAKZDHHEHPC-UHFFFAOYSA-M

Cite this record

CBID:129510 http://www.chembase.cn/molecule-129510.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
sodium bromate
IUPAC Traditional name
sodium bromate
Synonyms
Sodium bromate
Sodium bromate(V)
Bromic acid, sodium salt
Sodium bromate
溴酸钠
CAS Number
7789-38-0
EC Number
232-160-4
MDL Number
MFCD00003476
Merck Index
148593
PubChem SID
24886169
24886168
162223802
24853461
24845235
PubChem CID
23668195
Chemspider ID
23009
Wikipedia Title
Sodium_bromate

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

Physical Property Safety Information Product Information Bioassay(PubChem)
Solubility
27.5 g/100 mL (0 °C)
36.4 g/100 g (20 °C)
48.8 g/100 mL (40 °C)
90.8 g/100 mL (100 °C) in water
expand Show data source
insoluble in ethanol expand Show data source
Soluble in water (2.5 parts in cold water, 1.1 part in boiling water) expand Show data source
Apperance
colorless or white solid expand Show data source
Crystalline expand Show data source
Melting Point
381°C expand Show data source
381°C dec. expand Show data source
Boiling Point
1390°C expand Show data source
Flash Point
381 °C expand Show data source
Density
3.339 g/cm3 expand Show data source
3.339 g/mL at 25 °C(lit.) expand Show data source
3.34 expand Show data source
Refractive Index
1.594 expand Show data source
Odor
odorless expand Show data source
pH
5.0-9.0 (25 °C, 50 mg/mL in H2O) expand Show data source
RTECS
EF8750000 expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
X expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
1494 expand Show data source
UN1494 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
German water hazard class
3 expand Show data source
Hazard Class
5.1 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Risk Statements
8-22-36/37/38 expand Show data source
8-22-36/38 expand Show data source
R8, R36, R37, R38 expand Show data source
Safety Statements
17-26-36 expand Show data source
17-26-36/37-60 expand Show data source
S26, S27, S36, S37, S39 expand Show data source
TSCA Listed
expand Show data source
EU Index
Not listed expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS06 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Danger expand Show data source
Main Hazard
Oxidizing agent expand Show data source
NFPA704
NFPA 704 diagram
0
1
0
OX
expand Show data source
GHS Hazard statements
H272-H301-H315-H319 expand Show data source
H272-H302-H315-H319-H335 expand Show data source
GHS Precautionary statements
P220-P261-P305 + P351 + P338 expand Show data source
P221-P210-P301+P310-P305+P351+P338-P405-P501A expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 1494 5.1/PG 2 expand Show data source
Purity
≥99% expand Show data source
≥99.0% expand Show data source
≥99.0% (RT) expand Show data source
≥99.5% (RT) expand Show data source
99.5% (metals basis) expand Show data source
Grade
puriss. p.a. expand Show data source
purum p.a. expand Show data source
SAJ first grade expand Show data source
Impurities
≤0.001% total nitrogen (N) expand Show data source
≤0.005% heavy metals (as Pb) expand Show data source
Cation Traces
Ca: ≤10 mg/kg expand Show data source
Ca: ≤50 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: ≤5 mg/kg expand Show data source
Fe: ≤50 mg/kg expand Show data source
K: ≤100 mg/kg expand Show data source
K: ≤200 mg/kg expand Show data source
Mg: ≤5 mg/kg expand Show data source
Mn: ≤5 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
Zn: ≤5 mg/kg expand Show data source
Zn: ≤50 mg/kg expand Show data source
Antion Traces
bromide (Br-): ≤500 mg/kg expand Show data source
sulfate (SO42-): ≤1000 mg/kg expand Show data source
sulfate (SO42-): ≤500 mg/kg expand Show data source
Linear Formula
NaBrO3 expand Show data source

DETAILS

DETAILS

Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 224871 external link
Application
Useful oxidant for the transformation of tetrahydropyranyl ethers to carbonyl compounds.1
Packaging
100, 500 g in glass bottle
Sigma Aldrich - 71325 external link
Other Notes
Cooxidant for a catalytic cerium(IV) oxidation procedure1,2

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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