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358731-94-9 molecular structure
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chlorotris(2H5)phenylstannane

ChemBase ID: 135351
Molecular Formular: C18H15ClSn
Molecular Mass: 385.4657
Monoisotopic Mass: 385.98842216
SMILES and InChIs

SMILES:
c1ccc(cc1)[Sn](c1ccccc1)(c1ccccc1)Cl
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:135351 http://www.chembase.cn/molecule-135351.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
chlorotris(2H5)phenylstannane
IUPAC Traditional name
chlorotris(2H5)phenylstannane
Synonyms
Triphenyl-d15-tin chloride
三苯基-d15-氯化锡
CAS Number
358731-94-9
MDL Number
MFCD01861652
PubChem SID
162229625
PubChem CID
12309476

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
615625 external link Add to cart Please log in.
Data Source Data ID
PubChem 12309476 external link

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 36.693016 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)
Melting Point
108 °C(lit.) expand Show data source
Boiling Point
240 °C/13.5 mmHg(lit.) expand Show data source
Mass Shift
M+15 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
3261 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
3 expand Show data source
Risk Statements
34 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H314 expand Show data source
GHS Precautionary statements
P280-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 3261 8/PG 3 expand Show data source
Isotopic Purity
98 atom % D expand Show data source
Mol. Weight
mol wt 400.27 by atom % calculation expand Show data source
Linear Formula
(C6D5)3SnCl expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 615625 external link
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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