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| CAS No.: | 6485-81-0 |
|---|---|
| Name: | TRIISOBUTYLSILANE |
| Article Data: | 10 |
| Molecular Structure: | |
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| Formula: | C12H28Si |
| Molecular Weight: | 200.44 |
| Synonyms: | Silane,triisobutyl- (6CI,7CI,8CI);Triisobutylsilane; |
| Density: | 0.764 g/mL at 25 °C(lit.) |
| Boiling Point: | 205 °C at 760 mmHg |
| Flash Point: | 109.4 °C |
| Appearance: | clear colorless liquid |
| Hazard Symbols: |
 Xi
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| Risk Codes: | 36/37/38 |
| Safety: | 26-36/37 |
| PSA: | 0.00000 |
| LogP: | 4.18150 |
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Specification
The Silane,tris(2-methylpropyl)-, with the CAS registry number 6485-81-0, is also known as Triisobutylsilane. It belongs to the product categories of Organometallic Reagents; Organosilicon; Others. This chemical's molecular formula is C12H28Si and molecular weight is 200.4362. Its systematic name is called tris(2-methylpropyl)silane. This chemical is clear colorless liquid.
Physical properties of Silane,tris(2-methylpropyl)-: (1)ACD/LogP: 6.30; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.3; (4)ACD/LogD (pH 7.4): 6.3; (5)ACD/BCF (pH 5.5): 35948.18; (6)ACD/BCF (pH 7.4): 35948.18; (7)ACD/KOC (pH 5.5): 63465.39; (8)ACD/KOC (pH 7.4): 63465.39; (9)#Freely Rotating Bonds: 6; (10)Flash Point: 109.4 °C; (11)Enthalpy of Vaporization: 42.32 kJ/mol; (12)Boiling Point: 205 °C at 760 mmHg; (13)Vapour Pressure: 0.366 mmHg at 25°C.
Preparation: this chemical can be prepared by isobutylmagnesium bromide. This reaction will need reagent Cl3SiH and solvent diethyl ether, heptane. The reaction time is 24 hours by heating. The yield is about 72%.
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Uses of Silane,tris(2-methylpropyl)-: it can be used to produce triisobutyl-silanol at temperature of 80 °C. This reaction will need reagent air, water, [RuCl2(p-cymene)]2 and solvent acetonitrile with reaction time of 4 hours. The yield is about 85%.
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When you are using this chemical, please be cautious about it as the following:
This chemical may cause inflammation to the skin or other mucous membranes. It is irritating to eyes, respiratory system and skin. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice. Whenever you will contact it, please wear suitable protective clothing and gloves.
You can still convert the following datas into molecular structure:
(1)SMILES: C(C[SiH](CC(C)C)CC(C)C)(C)C
(2)InChI: InChI=1/C12H28Si/c1-10(2)7-13(8-11(3)4)9-12(5)6/h10-13H,7-9H2,1-6H3
(3)InChIKey: BORQTRQJFUNMBC-UHFFFAOYAV