The Benzene,[1-[(trimethylsilyl)oxy]ethenyl]-, with CAS registry number 13735-81-4, belongs to the following product categories: (1)Monoalkoxysilanes; (2)Si (Classes of Silicon Compounds); (3)Silicon Compounds (for Synthesis); (4)Si-O Compounds; (5)Synthetic Organic Chemistry. It has the systematic name of trimethyl[(1-phenylethenyl)oxy]silane. This chemical should be stored at the temperature of −20°C. What's more, its EINECS is 237-308-1.
Physical properties of Benzene,[1-[(trimethylsilyl)oxy]ethenyl]-: (1)ACD/LogP: 3.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.188; (4)ACD/LogD (pH 7.4): 3.188; (5)ACD/BCF (pH 5.5): 155.909; (6)ACD/BCF (pH 7.4): 155.909; (7)ACD/KOC (pH 5.5): 1292.012; (8)ACD/KOC (pH 7.4): 1292.012; (9)#H bond acceptors: 1; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2; (13)Index of Refraction: 1.484; (14)Molar Refractivity: 60.18 cm3; (15)Molar Volume: 210.358 cm3; (16)Polarizability: 23.857×10-24cm3; (17)Surface Tension: 25.082 dyne/cm; (18)Density: 0.914 g/cm3; (19)Flash Point: 76.08 °C; (20)Enthalpy of Vaporization: 43.143 kJ/mol; (21)Boiling Point: 213.452 °C at 760 mmHg; (22)Vapour Pressure: 0.239 mmHg at 25°C.
When you are using this chemical, please be cautious about it as the following:
The Benzene,[1-[(trimethylsilyl)oxy]ethenyl]- irritates to eyes, respiratory system and skin. When use it, wear suitable protective clothing, gloves and eye/face protection. If contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: C[Si](C)(C)OC(=C)c1ccccc1
(2)InChI: InChI=1/C11H16OSi/c1-10(12-13(2,3)4)11-8-6-5-7-9-11/h5-9H,1H2,2-4H3
(3)InChIKey: AFFPCIMDERUIST-UHFFFAOYAB
(4)Std. InChI: InChI=1S/C11H16OSi/c1-10(12-13(2,3)4)11-8-6-5-7-9-11/h5-9H,1H2,2-4H3
(5)Std. InChIKey: AFFPCIMDERUIST-UHFFFAOYSA-N
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