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7342-47-4 molecular structure
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tributyl(iodo)stannane

ChemBase ID: 148052
Molecular Formular: C12H27ISn
Molecular Mass: 416.94825
Monoisotopic Mass: 418.01794286
SMILES and InChIs

SMILES:
CCCC[Sn](CCCC)(CCCC)I
Canonical SMILES:
CCCC[Sn](CCCC)(CCCC)I
InChI:
InChI=1S/3C4H9.HI.Sn/c3*1-3-4-2;;/h3*1,3-4H2,2H3;1H;/q;;;;+1/p-1
InChIKey:
YHHVXVNXTMIXOL-UHFFFAOYSA-M

Cite this record

CBID:148052 http://www.chembase.cn/molecule-148052.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tributyl(iodo)stannane
IUPAC Traditional name
stannane, iodotributyl-
Synonyms
Iodotributyltin
Tributyltin iodide
碘化三丁基锡
三丁基碘化锡
CAS Number
7342-47-4
MDL Number
MFCD00074996
PubChem SID
162242231
24860097
PubChem CID
23765

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
333034 external link Add to cart Please log in.
Data Source Data ID
PubChem 23765 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.8285  LogD (pH = 7.4) 4.8285 
Log P 4.8285  Molar Refractivity 72.2185 cm3
Polarizability 33.244587 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
172 °C/10 mmHg(lit.) expand Show data source
Flash Point
113 °C expand Show data source
235.4 °F expand Show data source
Density
1.46 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.53(lit.) expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
3265 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
21-25-36/38-48/23/25-50/53 expand Show data source
Safety Statements
36/37/39-45-60-61 expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS08 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301-H312-H315-H319-H372-H410 expand Show data source
GHS Precautionary statements
P273-P280-P301 + P310-P305 + P351 + P338-P314-P501 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 3265 8/PG 2 expand Show data source
Purity
90% expand Show data source
Grade
technical grade expand Show data source
Contains
copper as stabilizer expand Show data source
Linear Formula
[CH3(CH2)3]3SnI expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 333034 external link
Packaging
10, 50 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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