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2767-54-6 molecular structure
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triethylstannylium bromide

ChemBase ID: 303851
Molecular Formular: C6H15BrSn
Molecular Mass: 285.7883
Monoisotopic Mass: 285.93790648
SMILES and InChIs

SMILES:
CC[Sn+](CC)CC.[Br-]
Canonical SMILES:
CC[Sn+](CC)CC.[Br-]
InChI:
InChI=1S/3C2H5.BrH.Sn/c3*1-2;;/h3*1H2,2H3;1H;/q;;;;+1/p-1
InChIKey:
KQPIFPBKXYBDGV-UHFFFAOYSA-M

Cite this record

CBID:303851 http://www.chembase.cn/molecule-303851.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
triethylstannylium bromide
IUPAC Traditional name
triethylstannylium bromide
Synonyms
Bromotriethylstannane
Triethyltin bromide
三乙基溴化锡
CAS Number
2767-54-6
EC Number
220-443-5
MDL Number
MFCD00000052

DATA SOURCES

DATA SOURCES

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Data Source Data ID
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CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.934  LogD (pH = 7.4) 0.934 
Log P 0.934  Molar Refractivity 31.0407 cm3
Polarizability 16.89129 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Bioassay(PubChem)
Apperance
Liquid expand Show data source
Melting Point
-13.5°C expand Show data source
Boiling Point
223-225°C expand Show data source
Flash Point
99°C(210°F) expand Show data source
Density
1.63 expand Show data source
Refractive Index
1.520 expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Highly toxic Highly toxic (T+) expand Show data source
UN Number
UN2788 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
II expand Show data source
Risk Statements
26/27/28-50/53 expand Show data source
Safety Statements
26-27/28-45-60-61 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS09 expand Show data source
GHS Hazard statements
H300-H310-H330-H400-H410 expand Show data source
GHS Precautionary statements
P260-P301+P310-P304+P340-P320-P330-P361-P405-P501A expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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