The Benzenesulfonylchloride, 4-[2-(trichlorosilyl)ethyl]-, with the CAS registry number of 79793-00-3, is also known as 4-[2-(Trichlorosilyl)ethyl]-benzenesulfonylchlorid. Its EINECS registry number is 279-267-2. This chemical's molecular formula is C11H17ClO5SSi and molecular weight is 324.85. What's more, both its IUPAC name and systematic name is 4-(2-Trichlorosilylethyl)benzenesulfonyl chloride. This chemical's classification code is Tsca flag p [a commenced pmn (premanufacture notice) substance].
Physical properties about the Benzenesulfonylchloride, 4-[2-(trichlorosilyl)ethyl]- are: (1)ACD/LogP: 6.15; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 6.15; (4)ACD/LogD (pH 7.4): 6.15; (5)ACD/BCF (pH 5.5): 27897.96; (6) ACD/BCF (pH 7.4): 27897.96; (7)ACD/KOC (pH 5.5): 52932.91; (8)ACD/KOC (pH 7.4): 52932.91; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 42.52 Å2; (13)Index of Refraction: 1.55; (14)Molar Refractivity: 72.91 cm3; (15)Molar Volume: 228.7 cm3; (16)Surface Tension: 40.5 dyne/cm; (17)Density: 1.477 g/cm3; (18)Flash Point: 174.9 °C; (19)Enthalpy of Vaporization: 58.78 kJ/mol; (20)Boiling Point: 365.6 °C at 760 mmHg; (21)Vapour Pressure: 3.27E-05 mmHg at 25°C.
When you are using this chemical, you should wear suitable protective clothing, gloves and eye/face protection. If it contacts with eyes, rinse eyes immediately with plenty of water and seek medical advice. Besides, if you feel unwell seek medical advice immediately (show the label where possible). This chemical may cause burns and do a carcinogenic effect, so please be cautious when you use it.
You can still convert the following datas into molecular structure:
(1) SMILES: ClS(=O)(=O)c1ccc(cc1)CC[Si](Cl)(Cl)Cl
(2) InChI: InChI=1/C8H8Cl4O2SSi/c9-15(13,14)8-3-1-7(2-4-8)5-6-16(10,11)12/h1-4H,5-6H2
(3) InChIKey: IHBDUARGLPMOND-UHFFFAOYAL
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