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Basic Information
CAS No.: 118162-95-1
Name: Methyl(3,3,3-trifluoropropyl)diethoxysilane
Molecular Structure:
Molecular Structure of 118162-95-1 (Methyl(3,3,3-trifluoropropyl)diethoxysilane)
Formula: C8H17F3O2Si
Molecular Weight: 230.302
Synonyms: Diethoxy-methyl-(3,3,3-trifluoropropyl)silane;
Density: 1.0±0.1 g/cm3
Boiling Point: 159.0±35.0 °C at 760 mmHg
Flash Point: 50.0±25.9 °C
PSA: 18.46000
LogP: 3.08380
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Specification

The Methyl(3,3,3-trifluoropropyl)diethoxysilane, with the CAS registry number 118162-95-1, is also known as Silane,diethoxymethyl(3,3,3-trifluoropropyl)-. This chemical's molecular formula is C8H17F3O2Si and molecular weight is 230.30. What's more, both its IUPAC name and systematic name are the same which is called Diethoxy-methyl-(3,3,3-trifluoropropyl)silane. It should be stored in a cool, dry and well-ventilated place.

Physical properties about Methyl(3,3,3-trifluoropropyl)diethoxysilane are: (1)ACD/LogP: 1.79±0.54; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.79; (4)ACD/LogD (pH 7.4): 1.79; (5)ACD/BCF (pH 5.5): 13.54; (6)ACD/BCF (pH 7.4): 13.54; (7)ACD/KOC (pH 5.5): 224.67; (8)ACD/KOC (pH 7.4): 224.67; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 18.46 Å2; (13)Index of Refraction: 1.376; (14)Molar Refractivity: 51.8±0.3 cm3; (15)Molar Volume: 225.4±3.0 cm3; (16)Polarizability: 20.5±0.5×10-24 cm3; (17)Surface Tension: 19.3±3.0 dyne/cm; (18)Density: 1.0±0.1 g/cm3; (19)Flash Point: 50.0±25.9 °C; (20)Enthalpy of Vaporization: 37.9±3.0 kJ/mol; (21)Boiling Point: 159.0±35.0 °C at 760 mmHg; (22)Vapour Pressure: 3.3±0.3 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CCO[Si](C)(CCC(F)(F)F)OCC
(2) InChI: InChI=1S/C8H17F3O2Si/c1-4-12-14(3,13-5-2)7-6-8(9,10)11/h4-7H2,1-3H3
(3) InChIKey: VJYNTADJZPKUAF-UHFFFAOYSA-N