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639-58-7 molecular structure
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chlorotriphenylstannane

ChemBase ID: 111509
Molecular Formular: C18H15ClSn
Molecular Mass: 385.4657
Monoisotopic Mass: 385.98842216
SMILES and InChIs

SMILES:
Cl[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
Canonical SMILES:
Cl[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
InChI:
InChI=1S/3C6H5.ClH.Sn/c3*1-2-4-6-5-3-1;;/h3*1-5H;1H;/q;;;;+1/p-1
InChIKey:
NJVOZLGKTAPUTQ-UHFFFAOYSA-M

Cite this record

CBID:111509 http://www.chembase.cn/molecule-111509.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
chlorotriphenylstannane
IUPAC Traditional name
triphenyltin chloride
Synonyms
Chlorotriphenyltin
TRIPHENYL TIN CHLORIDE
Chlorotriphenylstannane
Fentin chloride
Triphenyltin chloride
Triphenyltin chloride
Triphenyltin chloride
Fentin chloride
三苯锡基氯化物
氯三苯基锡
三苯基氯化锡
三苯基氯化锡
CAS Number
639-58-7
EC Number
211-358-4
MDL Number
MFCD00000519
Beilstein Number
524762
PubChem SID
24868031
162089615
24854753
24889811
24868994
PubChem CID
12540
CHEMBL
515580
Chemspider ID
12023
Wikipedia Title
Triphenyltin_chloride

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 3.7811  LogD (pH = 7.4) 3.7811 
Log P 3.7811  Molar Refractivity 82.5592 cm3
Polarizability 36.6321 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)
Solubility
organic solvents expand Show data source
Apperance
colourless solid expand Show data source
Melting Point
103-106 °C expand Show data source
103-106°C expand Show data source
108 °C expand Show data source
108 °C (dec.)(lit.) expand Show data source
108°C expand Show data source
Boiling Point
240 °C expand Show data source
240 °C/13.5 mmHg(lit.) expand Show data source
240°C/13.5mm expand Show data source
Flash Point
>110°C(230°F) expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
RTECS
WH6860000 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
3146 expand Show data source
UN3146 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
3 expand Show data source
III expand Show data source
Risk Statements
23/24/25-50/53 expand Show data source
R:25-36/37/38 expand Show data source
Safety Statements
26-27/28a-45-60-61 expand Show data source
26-27-28-45-60-61 expand Show data source
S:28-29-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301-H311-H331-H400-H410 expand Show data source
H301-H311-H331-H410 expand Show data source
GHS Precautionary statements
P261-P273-P280-P301 + P310-P311-P501 expand Show data source
P261-P301+P310-P361-P302+P352-P405-P501A expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P2 (EN 143) respirator cartridges, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 3146 6.1/PG 3 expand Show data source
Storage Temperature
2-8°C expand Show data source
Purity
≥97.0% (AT) expand Show data source
95% expand Show data source
Grade
analytical standard expand Show data source
PESTANAL®, analytical standard expand Show data source
purum expand Show data source
Certificate of Analysis
Download expand Show data source
Packaging
ampule of 500 mg expand Show data source
Linear Formula
(C6H5)3SnCl expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Wikipedia Wikipedia Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05219579 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - 245712 external link
Packaging
500 g in glass bottle
Sigma Aldrich - 45492 external link
Legal Information
PESTANAL is a registered trademark of Sigma-Aldrich Laborchemikalien GmbH

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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