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64724-29-4 molecular structure
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tributyl[(Z)-2-ethoxyethenyl]stannane

ChemBase ID: 64163
Molecular Formular: C16H34OSn
Molecular Mass: 361.14156
Monoisotopic Mass: 362.16315971
SMILES and InChIs

SMILES:
C(=C\OCC)\[Sn](CCCC)(CCCC)CCCC
Canonical SMILES:
CCCC[Sn](/C=C\OCC)(CCCC)CCCC
InChI:
InChI=1S/C4H7O.3C4H9.Sn/c1-3-5-4-2;3*1-3-4-2;/h1,3H,4H2,2H3;3*1,3-4H2,2H3;
InChIKey:
WARKYKQCOXTIAO-UHFFFAOYSA-N

Cite this record

CBID:64163 http://www.chembase.cn/molecule-64163.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
tributyl[(Z)-2-ethoxyethenyl]stannane
IUPAC Traditional name
tributyl[(Z)-2-ethoxyethenyl]stannane
Synonyms
(Z)-Tributyl[2-ethoxyethenyl]stannane
cis-1-Ethoxy-2-(tributylstannyl)ethylene
Tributyl((Z)-2-ethoxyvinyl)stannane
cis-Tributyl[2-ethoxyethenyl]stannane
(Z)-1-Ethoxy-2-(tributylstannyl)ethene
(Z)-三丁基[2-乙氧基乙烯基]锡烷
三丁基((Z)-2-乙氧基乙烯基)锡烷
顺-1-乙氧基-2-(三丁基锡)乙烯
顺-三丁基[2-乙氧基乙烯基]锡烷
CAS Number
64724-29-4
MDL Number
MFCD07787391
PubChem SID
162029902
PubChem CID
5706773

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 5706773 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 6.9311  LogD (pH = 7.4) 6.9311 
Log P 6.9311  Molar Refractivity 79.3755 cm3
Polarizability 35.968628 Å3 Polar Surface Area 9.23 Å2
Rotatable Bonds 12  Lipinski's Rule of Five false 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
84-87 °C/1 mmHg expand Show data source
84-87°C expand Show data source
Flash Point
>110 °C expand Show data source
>230 °F expand Show data source
Density
1.082 expand Show data source
1.082 g/mL at 25 °C expand Show data source
Refractive Index
n20/D 1.479 expand Show data source
Storage Warning
TOXIC 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
2788 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
Risk Statements
21-25-36/38-48/23/25-50/53 expand Show data source
Safety Statements
35-36/37/39-45-60-61 expand Show data source
TSCA Listed
false 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
RID/ADR
UN 2788 6.1/PG 3 expand Show data source
Storage Temperature
2-8°C expand Show data source
Purity
94% expand Show data source
97% expand Show data source
Empirical Formula (Hill Notation)
C16H34OSn expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 707937 external link
Packaging
1, 5 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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