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| CAS No.: | 138983-08-1 |
|---|---|
| Name: | T-Butyl(Dichloromethyl)Dimethylsilane |
| Article Data: | 3 |
| Molecular Structure: | |
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|
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| Formula: | C7H16Cl2Si |
| Molecular Weight: | 199.196 |
| Synonyms: | TERT-BUTYL(DICHLOROMETHYL)DIMETHYLSILANE;T-BUTYL(DICHLOROMETHYL)DIMETHYLSILANE |
| Density: | 0.981g/cm3 |
| Melting Point: | 42-45 °C(lit.) |
| Boiling Point: | 193.9 °C at 760 mmHg |
| Flash Point: | 69.3 °C |
| Hazard Symbols: |
 F
|
| Risk Codes: | 11 |
| Safety: | 16 |
| Transport Information: | UN 1325 |
| PSA: | 0.00000 |
| LogP: | 4.25770 |
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Specification
The T-Butyl(Dichloromethyl)Dimethylsilane, with CAS registry number 138983-08-1, belongs to the following product categories: (1)Organometallic Reagents; (2)Organosilicon; (3)Others. It has the systematic name of tert-butyl(dichloromethyl)dimethylsilane. This chemical is highly flammable, so keep it away from sources of ignition. And the chemical formula of this chemical is C7H16Cl2Si.
Physical properties of T-Butyl(Dichloromethyl)Dimethylsilane: (1)ACD/LogP: 3.78; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.78; (4)ACD/LogD (pH 7.4): 3.78; (5)ACD/BCF (pH 5.5): 439.64; (6)ACD/BCF (pH 7.4): 439.64; (7)ACD/KOC (pH 5.5): 2713.52; (8)ACD/KOC (pH 7.4): 2713.52; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.433; (14)Molar Refractivity: 52.81 cm3; (15)Molar Volume: 203 cm3; (16)Polarizability: 20.93×10-24cm3; (17)Surface Tension: 21.8 dyne/cm; (18)Density: 0.981 g/cm3; (19)Flash Point: 69.3 °C; (20)Enthalpy of Vaporization: 41.25 kJ/mol; (21)Boiling Point: 193.9 °C at 760 mmHg; (22)Vapour Pressure: 0.633 mmHg at 25°C.
Preparation: this chemical can be prepared by tert-butyl-chloro-dimethyl-silane and dichloromethane. This reaction will need reagent lithium diisopropylamide and solvent tetrahydrofuran. The reaction temperature is -78 ℃. The yield is about 85%.
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You can still convert the following datas into molecular structure:
(1)SMILES: ClC(Cl)[Si](C(C)(C)C)(C)C
(2)InChI: InChI=1/C7H16Cl2Si/c1-7(2,3)10(4,5)6(8)9/h6H,1-5H3
(3)InChIKey: IIGQYABNVUNASW-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C7H16Cl2Si/c1-7(2,3)10(4,5)6(8)9/h6H,1-5H3
(5)Std. InChIKey: IIGQYABNVUNASW-UHFFFAOYSA-N