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10039-54-0 molecular structure
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bis(hydroxyazanium) sulfate

ChemBase ID: 127756
Molecular Formular: H8N2O6S
Molecular Mass: 164.13832
Monoisotopic Mass: 164.01030699
SMILES and InChIs

SMILES:
[O-]S(=O)(=O)[O-].O[NH3+].O[NH3+]
Canonical SMILES:
[O-]S(=O)(=O)[O-].[NH3+]O.[NH3+]O
InChI:
InChI=1S/2H4NO.H2O4S/c2*1-2;1-5(2,3)4/h2*2H,1H3;(H2,1,2,3,4)/q2*+1;/p-2
InChIKey:
VGYYSIDKAKXZEE-UHFFFAOYSA-L

Cite this record

CBID:127756 http://www.chembase.cn/molecule-127756.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
bis(hydroxyazanium) sulfate
IUPAC Traditional name
bis(hydroxyazanium) sulfate
Synonyms
Hydroxylamine sulfate
Hydroxylammonium sulfate
CAS Number
10039-54-0
EC Number
233-118-8
PubChem SID
162222074
PubChem CID
24846
Chemspider ID
23229
Wikipedia Title
Hydroxylammonium_sulfate

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -3.034349  H Acceptors
H Donor LogD (pH = 5.5) -5.569452 
LogD (pH = 7.4) -5.594027  Log P -0.841552 
Molar Refractivity 11.5274 cm3 Polarizability 6.037845 Å3
Polar Surface Area 80.26 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Bioassay(PubChem)
Solubility
58.7 g/100 ml (20 °C) in water expand Show data source
Apperance
white crystalline to fine product, slightly hygroscopic expand Show data source
Melting Point
around 120 °C decomp. expand Show data source
Density
1.88 g/cm3 expand Show data source
RTECS
NC5425000 expand Show data source
European Hazard Symbols
Carc3 expand Show data source
Explosive Explosive (E) expand Show data source
Nature polluting Nature polluting (N) expand Show data source
Toxic Toxic (T) expand Show data source
Irritant Irritant (Xi) expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
2865 expand Show data source
Risk Statements
R2, R21/22, R36/38, R40, R43, R48/22, R50 expand Show data source
Safety Statements
S2, S36/37, S61 expand Show data source
EU Index
612-123-00-2 expand Show data source
NFPA704
NFPA 704 diagram
1
3
2
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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