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595-90-4 molecular structure
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tetraphenylstannane

ChemBase ID: 109591
Molecular Formular: C24H20Sn
Molecular Mass: 427.1166
Monoisotopic Mass: 428.05869464
SMILES and InChIs

SMILES:
c1ccc(cc1)[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
Canonical SMILES:
c1ccc(cc1)[Sn](c1ccccc1)(c1ccccc1)c1ccccc1
InChI:
InChI=1S/4C6H5.Sn/c4*1-2-4-6-5-3-1;/h4*1-5H;
InChIKey:
CRHIAMBJMSSNNM-UHFFFAOYSA-N

Cite this record

CBID:109591 http://www.chembase.cn/molecule-109591.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tetraphenylstannane
IUPAC Traditional name
tetraphenyl tin
Synonyms
TETRAPHENYL TIN
Tin tetraphenyl
Tetraphenyltin
Tetraphenylstannane
四苯锡
四苯基锡
CAS Number
595-90-4
EC Number
209-872-9
MDL Number
MFCD00003006
Beilstein Number
3145842
PubChem SID
24900065
162095310
PubChem CID
61146

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 8.3588  LogD (pH = 7.4) 8.3588 
Log P 8.3588  Molar Refractivity 101.8972 cm3
Polarizability 44.393467 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
Crystalline expand Show data source
Melting Point
224-227 °C(lit.) expand Show data source
224-227°C expand Show data source
Boiling Point
>420 °C(lit.) expand Show data source
>420°C expand Show data source
Flash Point
>110°C(230°F) expand Show data source
111 °C expand Show data source
231.8 °F expand Show data source
Vapor Density
14.7 (vs air) expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Toxic Toxic (T) expand Show data source
Irritant Irritant (Xi) 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
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:36/37/38 expand Show data source
Safety Statements
26-27/28-45-60-61 expand Show data source
26-27-28-45-60-61 expand Show data source
S:20-25-26-37/39 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
RID/ADR
UN 3146 6.1/PG 3 expand Show data source
Purity
97% expand Show data source
Certificate of Analysis
Download expand Show data source
Linear Formula
Sn(C6H5)4 expand Show data source

DETAILS

DETAILS

MP Biomedicals MP Biomedicals Sigma Aldrich Sigma Aldrich
MP Biomedicals - 05211702 external link
MP Biomedicals Rare Chemical collection
Sigma Aldrich - T26727 external link
Packaging
5 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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