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1345-07-9 molecular structure
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dibismuth(3+) ion trisulfanediide

ChemBase ID: 107018
Molecular Formular: Bi2S3
Molecular Mass: 514.1558
Monoisotopic Mass: 513.877009
SMILES and InChIs

SMILES:
[SH2-2].[SH2-2].[SH2-2].[Bi+3].[Bi+3]
Canonical SMILES:
[SH2-2].[SH2-2].[SH2-2].[Bi+3].[Bi+3]
InChI:
InChI=1S/2Bi.3S/q2*+3;3*-2
InChIKey:
YNRGZHRFBQOYPP-UHFFFAOYSA-N

Cite this record

CBID:107018 http://www.chembase.cn/molecule-107018.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dibismuth(3+) ion trisulfanediide
IUPAC Traditional name
dibismuth(3+) ion trisulfide
dibismuth(3+) ion trisulfanediide
Synonyms
BISMUTH SULFIDE
Bismuth(III) sulfide
硫化铋(III)
CAS Number
1345-07-9
EC Number
215-716-0
MDL Number
MFCD00014204
PubChem SID
162092992
PubChem CID
160976

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 160976 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.06446023  LogD (pH = 7.4) -0.7196984 
Log P -0.0375  Molar Refractivity 5.7558 cm3
Polarizability 3.055504 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Chunks/Crystals expand Show data source
Density
7.7 expand Show data source
RTECS
EB3105000 expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H315-H319-H335-H303 expand Show data source
GHS Precautionary statements
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Purity
99.9% (metals basis) expand Show data source
Certificate of Analysis
Download expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals
MP Biomedicals - 05202246 external link
MP Biomedicals Rare Chemical collection

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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