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10555-76-7 molecular structure
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sodium tetrahydrate oxoborinate

ChemBase ID: 130640
Molecular Formular: BH9NaO6
Molecular Mass: 138.86863
Monoisotopic Mass: 139.03898769
SMILES and InChIs

SMILES:
[BH](=O)[O-].O.O.O.O.[Na+]
Canonical SMILES:
[O-][BH]=O.O.O.O.O.[Na+]
InChI:
InChI=1S/BO2.Na.4H2O/c2-1-3;;;;;/h;;4*1H2/q-1;+1;;;;
InChIKey:
JAKYJVJWXKRTSJ-UHFFFAOYSA-N

Cite this record

CBID:130640 http://www.chembase.cn/molecule-130640.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
sodium tetrahydrate oxoborinate
IUPAC Traditional name
sodium tetrahydrate boron oxide hydroxide
sodium tetrahydrate oxoborinate
Synonyms
Boric acid, sodium salt, tetrahydrate
Sodium metaborate tetrahydrate
偏硼酸钠 四水合物
四水偏硼酸钠
CAS Number
10555-76-7
EC Number
231-891-6
MDL Number
MFCD00149205
PubChem SID
24899432
162224918
PubChem CID
23694267

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 23694267 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.19313604  LogD (pH = 7.4) -0.44406706 
Log P 0.2124  Molar Refractivity 2.8858 cm3
Polarizability 2.9952743 Å3 Polar Surface Area 40.13 Å2
Rotatable Bonds Lipinski's Rule of Five true 
Acid pKa 6.840891 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
ca 53°C dec. expand Show data source
RTECS
ED4640000 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-36 expand Show data source
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Purity
≥99% expand Show data source
98% expand Show data source
Grade
CP expand Show data source
Linear Formula
NaBO2 · 4H2O expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - S0251 external link
Caution
在空气中易与 CO2 反应。
包装
1 kg in poly bottle
500 g in poly bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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