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153447-97-3 molecular structure
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trichloro(oct-7-en-1-yl)silane

ChemBase ID: 147278
Molecular Formular: C8H15Cl3Si
Molecular Mass: 245.6492
Monoisotopic Mass: 244.00086005
SMILES and InChIs

SMILES:
C=CCCCCCC[Si](Cl)(Cl)Cl
Canonical SMILES:
C=CCCCCCC[Si](Cl)(Cl)Cl
InChI:
InChI=1S/C8H15Cl3Si/c1-2-3-4-5-6-7-8-12(9,10)11/h2H,1,3-8H2
InChIKey:
MFISPHKHJHQREG-UHFFFAOYSA-N

Cite this record

CBID:147278 http://www.chembase.cn/molecule-147278.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
trichloro(oct-7-en-1-yl)silane
IUPAC Traditional name
trichloro(oct-7-en-1-yl)silane
Synonyms
Octenyltrichlorosilane, mixture of isomers
辛烯基三氯硅烷,异构体混合物
CAS Number
153447-97-3
MDL Number
MFCD00039292
PubChem SID
162241468
24878387
PubChem CID
104122

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
539279 external link Add to cart Please log in.
Data Source Data ID
PubChem 104122 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 4.5073  LogD (pH = 7.4) 4.5073 
Log P 4.5073  Molar Refractivity 56.1797 cm3
Polarizability 23.680033 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
223-224 °C(lit.) expand Show data source
Flash Point
199.4 °F expand Show data source
93 °C expand Show data source
Density
1.07 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.458(lit.) expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
UN Number
2987 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
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
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 2987 8/PG 2 expand Show data source
Purity
96% expand Show data source
Impurities
10-15% internal olefin isomers expand Show data source
Linear Formula
CH2=CH(CH2)6SiCl3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 539279 external link
Packaging
25 mL in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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