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766-77-8

Basic Information
CAS No.: 766-77-8
Name: Dimethylphenylsilane
Molecular Structure:
Molecular Structure of 766-77-8 (Dimethylphenylsilane)
Formula: C8H12Si
Molecular Weight: 136.26
Synonyms: Silane,dimethylphenyl- (6CI,7CI,8CI,9CI);(Dimethylsilyl)benzene;Dimethylphenylhydrosilane;Dimethylphenylsilane;LS 2010;Phenyldimethylsilane;SIP 6729;
EINECS: 212-170-5
Density: 212-170-5
Melting Point: 323-329 °C(lit.)
Boiling Point: 156.5 °C at 760 mmHg
Flash Point: 35 °C
Solubility: Not miscible in water.
Appearance: Clear colorless liquid
Hazard Symbols: IrritantXi
Risk Codes: 10-36
Safety: 26-36/39
Transport Information:
PSA: 0.00000
LogP: 1.38030
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    Name Dimethylphenylsilane Molecular Structure Molecular Formula C8H12Si Molecular Weight 1

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Specification

The Dimethylphenylsilane, with the CAS registry number 766-77-8 and EINECS registry number 212-170-5, has the systematic name of dimethyl(phenyl)silane. It is a kind of clear colorless liquid, and belongs to the following product categories: Reduction; Si (Classes of Silicon Compounds); Si-H Compounds; Silicon Compounds (for Synthesis); Synthetic Organic Chemistry. And the molecular formula of the chemical is C8H12Si.

The characteristics of Dimethylphenylsilane are as followings: (1)ACD/LogP: -1.06; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.56; (4)ACD/LogD (pH 7.4): -4.29; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 5; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 57.01 Å2; (13)Index of Refraction: 1.619; (14)Molar Refractivity: 34.8 cm3; (15)Molar Volume: 99.1 cm3; (16)Polarizability: 13.79×10-24cm3; (17)Surface Tension: 61.4 dyne/cm; (18)Density: 1.42 g/cm3; (19)Flash Point: 181.1 °C; (20)Enthalpy of Vaporization: 65.77 kJ/mol; (21)Boiling Point: 375.9 °C at 760 mmHg; (22)Vapour Pressure: 2.57E-06 mmHg at 25°C.

Uses of Dimethylphenylsilane: It can react with vinylbenzene to produce (b-Phenyl-ethyl)-dimethylphenyl-silan. This reaction will need reagent B(C6F5)3, and the menstruum CH2Cl2. The reaction temperature is 20°C, and the yield is about 96%.

You should be cautious while dealing with this chemical. It is a kind of flammable chemical which irritates to eyes. Therefore, you had better take the following instructions: Wear suitable protective clothing and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1ccccc1[SiH](C)C
(2)InChI: InChI=1/C8H12Si/c1-9(2)8-6-4-3-5-7-8/h3-7,9H,1-2H3
(3)InChIKey: ZISUALSZTAEPJH-UHFFFAOYAS