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Trichlorohexylsilane

Catalog Number
ACM928654-1
CAS Number
928-65-4
Product Name
Trichlorohexylsilane
Structure
Category
Silane Coupling Agents; Self Assembly and Contact Printing Materials
Synonyms
Hexyltrichlorosilane; 1,1,1-Trichloro-1-silaheptane; 1-Hexyltrichlorosilane
Description
Hexyltrichlorosilane is a colorless liquid with a pungent odor. It is decomposed by moist air or water to hydrochloric acid with evolution of heat. It is corrosive to metals and tissue. It is used as a chemical intermediate.;Liquid
IUPAC Name
trichloro(hexyl)silane
Molecular Weight
219.61
Molecular Formula
C6H13Cl3Si
Canonical SMILES
CCCCCC[Si](Cl)(Cl)Cl
InChI
InChI=1S/C6H13Cl3Si/c1-2-3-4-5-6-10(7,8)9/h2-6H2,1H3
InChI Key
LFXJGGDONSCPOF-UHFFFAOYSA-N
Boiling Point
192 °C
Flash Point
56 °C
Purity
>97% (GC)
Density
1.107 g/mL at 25 °C (lit.)
Appearance
Colorless to almost colorless clear liquid
Application
Trichlorohexylsilane is a versatile chemical intermediate that serves as a colorless liquid with a sharp penetrating odor, notable for its tendency to fume in moist air. With a molecular weight of 219.63, it exhibits a boiling point range of 191-192°C and a flash point of 85°C. In terms of safety and handling, it requires careful attention due to its reactivity with water and its hazard classification based on the NFPA-704 M Rating System: Health 3, Flammability 2, and Reactivity 2 with water.
Storage
Store under inert gas
Color/Form
Colorless liquid
Complexity
79.6
Corrosivity
Corrosive
Covalently-Bonded Unit Count
1
EC Number
213-178-1
Exact Mass
217.985210
Formal Charge
0
Heavy Atom Count
10
Hydrogen Bond Acceptor Count
0
Hydrogen Bond Donor Count
0
MDL Number
MFCD00013606
Monoisotopic Mass
217.985210
NSC Number
139843
Odor
Sharp penetrating odor
Other Experimental
Decomposes in water;Fumes strongly in moist air.;The reaction of organosilanes with halogens and halogen compounds usually proceeds in good yield through cleavage of the Si--H bond and formation of the silicon-halogen bond. Reaction with fluorine, however, does not proceed satisfactorily because of cleavage of not only the Si--H but also C--Si and C--H bonds. Direct halogenation with chlorination, bromine, and iodine proceeds smoothly, however. /Organosilanes/
Rotatable Bond Count
4
Stability
Fumes strongly in moist air.
Topological Polar Surface Area
0 Ų
UNII
BJ5Z98918X
UN Number
1784;1784;1784
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