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22515-25-9

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Basic Information
CAS No.: 22515-25-9
Name: 4-TRIMETHYLSILYL-THIOANISOLE
Article Data: 9
Molecular Structure:
Molecular Structure of 22515-25-9 (4-TRIMETHYLSILYL-THIOANISOLE)
Formula: C10H16SSi
Molecular Weight: 196.389
Synonyms: Silane, trimethyl(4-(methylthio)phenyl)-;Trimethyl-(4-methylsulfanylphenyl)silane;
Density: 0.95 g/cm3
Boiling Point: 249 °C at 760 mmHg
Flash Point: 104.4 °C
PSA: 25.30000
LogP: 2.95370
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  • 4-TRIMETHYLSILYL-THIOANISOLE

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    4-TRIMETHYLSILYL-THIOANISOLE

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Specification

The Benzene,1-(methylthio)-4-(trimethylsilyl)-, with the CAS registry number 22515-25-9, is also known as Silane, trimethyl(4-(methylthio)phenyl)-. This chemical's molecular formula is C10H16SSi and molecular weight is 196.38. What's more, its IUPAC name is trimethyl-(4-methylsulfanylphenyl)silane.

Physical properties of Benzene,1-(methylthio)-4-(trimethylsilyl)- are: (1)ACD/LogP: 5.21; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5.21; (4)ACD/LogD (pH 7.4): 5.21; (5)ACD/BCF (pH 5.5): 5328.33; (6)ACD/BCF (pH 7.4): 5328.33; (7)ACD/KOC (pH 5.5): 16184.02; (8)ACD/KOC (pH 7.4): 16184.02; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 25.3 Å2; (13)Index of Refraction: 1.516; (14)Molar Refractivity: 62.03 cm3; (15)Molar Volume: 205.1 cm3; (16)Polarizability: 24.59×10-24cm3; (17)Surface Tension: 28.6 dyne/cm; (18)Density: 0.95 g/cm3; (19)Flash Point: 104.4 °C; (20)Enthalpy of Vaporization: 46.65 kJ/mol; (21)Boiling Point: 249 °C at 760 mmHg; (22)Vapour Pressure: 0.0371 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: S(c1ccc(cc1)[Si](C)(C)C)C
(2)Std. InChI: InChI=1S/C10H16SSi/c1-11-9-5-7-10(8-6-9)12(2,3)4/h5-8H,1-4H3
(3)Std. InChIKey: IJZLJXUFHVCGMR-UHFFFAOYSA-N