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17760-13-3

Basic Information
CAS No.: 17760-13-3
Name: TRICHLOROMETHYLTRICHLOROSILANE
Article Data: 24
Molecular Structure:
Molecular Structure of 17760-13-3 (TRICHLOROMETHYLTRICHLOROSILANE)
Formula: CCl6Si
Molecular Weight: 252.815
Synonyms: (Trichloromethyl)trichlorosilane;Trichloro(trichloromethyl)silane;
EINECS: 241-747-4
Density: 1.695 g/cm3
Melting Point: 112-115 °C(lit.)
Boiling Point: 205 °C at 760 mmHg
Flash Point: 93.7 °C
Hazard Symbols: CorrosiveC
Risk Codes: 14-34
Safety: 22-26-36/37/39-45
Transport Information: UN 2924
PSA: 0.00000
LogP: 3.97100
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Specification

This chemical is called Silane, trichloro(trichloromethyl)-, and its IUPAC name is trichloro(trichloromethyl)silane. With the molecular formula of CCl6Si, its molecular weight is 252.81. The CAS registry number of this chemical is 17760-13-3.

Other characteristics of the Silane, trichloro(trichloromethyl)- can be summarised as followings: (1)ACD/LogP: 6.13; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.13; (4)ACD/LogD (pH 7.4): 6.13; (5)ACD/BCF (pH 5.5): 26706.07; (6)ACD/BCF (pH 7.4): 26706.07; (7)ACD/KOC (pH 5.5): 51304.11; (8)ACD/KOC (pH 7.4): 51304.11; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.508; (13)Molar Refractivity: 44.45 cm3; (14)Molar Volume: 149.1 cm3; (15)Polarizability: 17.62×10-24cm3; (16)Surface Tension: 32.7 dyne/cm; (17)Density: 1.695 g/cm3; (18)Flash Point: 93.7 °C; (19)Enthalpy of Vaporization: 42.32 kJ/mol; (20)Boiling Point: 205 °C at 760 mmHg; (21)Vapour Pressure: 0.366 mmHg at 25°C.

Production method of this chemical: The Silane, trichloro(trichloromethyl)- could be obtained by the reactant of trichloro-methyl-silane. This reaction needs the reagent of Cl2, and the solvent of CCl4. The yield is 97 %.

Uses of this chemical: The trans-1,2-Dichloro-1,2-bis(trichlorosilyl)ethene could be obtained by the Silane, trichloro(trichloromethyl)-. This reaction needs the reagent of Cu powder. The yield is 51 %. In addition, this reaction should be taken for 40 hours at the temperature of 150 °C.

When you are using this chemical, please be cautious about it as the following: This chemical causes burns. It reacts violently with water. Do not breathe dust. You should wear suitable protective clothing if you use it. In case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure: 
1.SMILES: ClC(Cl)(Cl)[Si](Cl)(Cl)Cl
2.InChI: InChI=1/CCl6Si/c2-1(3,4)8(5,6)7
3.InChIKey: YWUUHVWMPSPGQO-UHFFFAOYAX