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Name |
Silanol,1,1-dimethyl-1-phenyl-, 1-acetate |
EINECS | 241-836-8 |
CAS No. | 17887-60-4 | Density | 0.99 g/cm3 |
PSA | 26.30000 | LogP | 1.66180 |
Solubility | N/A | Melting Point |
N/A |
Formula | C10H14O2Si | Boiling Point | 198.7 °C at 760 mmHg |
Molecular Weight | 194.305 | Flash Point | 61.6 °C |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Silanol,dimethylphenyl-, acetate (6CI,7CI,8CI,9CI);Dimethylphenylacetoxysilane;Dimethylphenylsilyl acetate;Phenyldimethylacetoxysilane;Dimethyl(phenyl)silyl acetate;Silanol, 1,1-dimethyl-1-phenyl-, acetate;Silanol, dimethylphenyl-, acetate; |
Article Data | 16 |
The Silanol,1,1-dimethyl-1-phenyl-, 1-acetate, with the CAS registry number 17887-60-4 and EINECS registry number 241-836-8, has the systematic name of dimethyl(phenyl)silyl acetate. And the molecular formula of the chemical is C10H14O2Si.
The characteristics of Silanol,1,1-dimethyl-1-phenyl-, 1-acetate are as followings: (1)ACD/LogP: 2.99; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.99; (4)ACD/LogD (pH 7.4): 2.99; (5)ACD/BCF (pH 5.5): 109.68; (6)ACD/BCF (pH 7.4): 109.68; (7)ACD/KOC (pH 5.5): 1004.46; (8)ACD/KOC (pH 7.4): 1004.46; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 26.3 Å2; (13)Index of Refraction: 1.485; (14)Molar Refractivity: 55.88 cm3; (15)Molar Volume: 194.9 cm3; (16)Polarizability: 22.15×10-24cm3; (17)Surface Tension: 28.2 dyne/cm; (18)Density: 0.99 g/cm3; (19)Flash Point: 61.6 °C; (20)Enthalpy of Vaporization: 43.49 kJ/mol; (21)Boiling Point: 198.7 °C at 760 mmHg; (22)Vapour Pressure: 0.356 mmHg at 25°C.
Uses of Silanol,1,1-dimethyl-1-phenyl-, 1-acetate: It can react with 6-oxabicyclo[3.1.0]hex-2-ene to produce acetic acid 4-(dimethyl-phenyl-silanyloxy)-cyclopent-2-enyl ester. This reaction will need reagent Pd(PPh3)4, and the menstruum tetrahydrofuran. The reaction time is 15 minutes with temperature of 0°C, and the yield is about 65%.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(O[Si](c1ccccc1)(C)C)C
(2)InChI: InChI=1/C10H14O2Si/c1-9(11)12-13(2,3)10-7-5-4-6-8-10/h4-8H,1-3H3
(3)InChIKey: KEVICWGPAZOCGD-UHFFFAOYAZ