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10101-91-4 molecular structure
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trisodium [disulfanidyl(sulfanylidene)stibanyl]sulfanide nonahydrate

ChemBase ID: 158516
Molecular Formular: H18Na3O9S4Sb
Molecular Mass: 481.12683
Monoisotopic Mass: 479.856489
SMILES and InChIs

SMILES:
O.O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+].[S-][Sb](=S)([S-])[S-]
Canonical SMILES:
[S-][Sb](=S)([S-])[S-].O.O.O.O.O.O.O.O.O.[Na+].[Na+].[Na+]
InChI:
InChI=1S/3Na.9H2O.4S.Sb/h;;;9*1H2;;;;;/q3*+1;;;;;;;;;;;3*-1;
InChIKey:
ZHSCVFVPXYYCAW-UHFFFAOYSA-N

Cite this record

CBID:158516 http://www.chembase.cn/molecule-158516.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
trisodium [disulfanidyl(sulfanylidene)stibanyl]sulfanide nonahydrate
IUPAC Traditional name
trisodium [disulfanidyl(sulfanylidene)stibanyl]sulfanide nonahydrate
Synonyms
Sodium thioantimonate(V) nonahydrate
硫代锑(V)酸钠 九水合物
CAS Number
10101-91-4
EC Number
237-414-8
MDL Number
MFCD00149486
PubChem SID
162252652
24847023
PubChem CID
71312650

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
11131 external link Add to cart Please log in.
Data Source Data ID
PubChem 71312650 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa 1.7016977  H Acceptors
H Donor LogD (pH = 5.5) -2.3761604 
LogD (pH = 7.4) -2.669342  Log P 1.5908 
Molar Refractivity 37.7352 cm3 Polarizability 19.722507 Å3
Polar Surface Area 0.0 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
1549 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
2 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
20/22-51/53 expand Show data source
Safety Statements
61 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H302-H332-H411 expand Show data source
GHS Precautionary statements
P273 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
RID/ADR
UN 1549 6.1/PG 3 expand Show data source
Purity
22.5% Sb basis expand Show data source
Cation Traces
Fe: 50 mg/kg expand Show data source
Antion Traces
chloride (Cl-): 100 mg/kg expand Show data source
Linear Formula
Na3SbS4 · 9H2O expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

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