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| CAS No.: | 18147-84-7 |
|---|---|
| Name: | 2-(CHLOROMETHYL)ALLYLTRICHLOROSILANE |
| Article Data: | 4 |
| Molecular Structure: | |
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|
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| Formula: | C4H6Cl4Si |
| Molecular Weight: | 223.989 |
| Synonyms: | Silane,trichloro[2-(chloromethyl)-2-propenyl]- (9CI);Silane,trichloro[2-(chloromethyl)allyl]- (8CI);2-(Chloromethyl)-3-(trichlorosilyl)propene; |
| Density: | 1.311 g/cm3 |
| Boiling Point: | 195.8 °C at 760 mmHg |
| Flash Point: | 80 °C |
| Hazard Symbols: |
 C
|
| Risk Codes: | 14-34 |
| Safety: | 26-27-36/37/39-45 |
| Transport Information: | UN 2987 8/PG 2 |
| PSA: | 0.00000 |
| LogP: | 3.43670 |
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Specification
The CAS register number of Silane,trichloro[2-(chloromethyl)-2-propen-1-yl]- is 18147-84-7. It also can be called as 2-(Chloromethyl)-3-(trichlorosilyl)propene and the systematic name about this chemical is trichloro[2-(chloromethyl)prop-2-en-1-yl]silane. The molecular formula about this chemical is C4H6Cl4Si and the molecular weight is 223.99. It belongs to the following product categories which include Poss Precursors and Intermediates; RSiCl3Self Assembly & Contact Printing; Self-Assembly Materials; Silanes; Silsesquioxanes: Poss Nanohybrids and so on.
Physical properties about Silane,trichloro[2-(chloromethyl)-2-propen-1-yl]- are: (1)ACD/LogP: 5.62; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.62; (4)ACD/LogD (pH 7.4): 5.62; (5)ACD/BCF (pH 5.5): 10995.16; (6)ACD/BCF (pH 7.4): 10995.16; (7)ACD/KOC (pH 5.5): 27182; (8)ACD/KOC (pH 7.4): 27182; (9)#Freely Rotating Bonds: 3; (10)Index of Refraction: 1.477; (11)Molar Refractivity: 48.26 cm3; (12)Molar Volume: 170.7 cm3; (13)Polarizability: 19.13x10-24cm3; (14)Surface Tension: 27 dyne/cm; (15)Density: 1.311 g/cm3; (16)Flash Point: 80 °C; (17)Enthalpy of Vaporization: 41.44 kJ/mol; (18)Boiling Point: 195.8 °C at 760 mmHg; (19)Vapour Pressure: 0.576 mmHg at 25 °C.
Preparation: this chemical can be prepared by 3-chloro-2-chloromethyl-propene. This reaction will need reagent trichlorosilane, cuprous chloride, triethylamine and solvent diethyl ether. This reaction needs ambient temperature. The reaction time is 14 hour(s). The yield is about 61%.
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Uses of Silane,trichloro[2-(chloromethyl)-2-propen-1-yl]-: it can be used to produce (2-chloromethyl-allyl)-trimethyl-silane with methylmagnesium bromide. This reaction will need solvent diethyl ether. This reaction needs 1.) -78 deg C, 1 h, 2.) RT, 10 h. The yield is about 81%.
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When you are using this chemical, please be cautious about it as the following:
This chemical can react violently with water. Also it can cause burns. If you want to store this chemical, wear suitable protective clothing, gloves and eye/face protection. When you are using it, take off immediately all contaminated clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. In case of accident or if you feel unwell, seek medical advice immediately (show the label whenever possible.)
You can still convert the following datas into molecular structure:
(1)SMILES: ClC/C(=C)C[Si](Cl)(Cl)Cl
(2)InChI: InChI=1/C4H6Cl4Si/c1-4(2-5)3-9(6,7)8/h1-3H2
(3)InChIKey: SJFJNNLIAXEOSE-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C4H6Cl4Si/c1-4(2-5)3-9(6,7)8/h1-3H2
(5)Std. InChIKey: SJFJNNLIAXEOSE-UHFFFAOYSA-N