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3510-72-3

Basic Information
CAS No.: 3510-72-3
Name: METHYLTRI-N-OCTYLSILANE
Article Data: 1
Molecular Structure:
Molecular Structure of 3510-72-3 (METHYLTRI-N-OCTYLSILANE)
Formula: C25H54Si
Molecular Weight: 382.789
Synonyms: Methyltri-n-octylsilane;Methyltrioctylsilane;
Density: 0.802 g/cm3
Boiling Point: 431 °C at 760 mmHg
Flash Point: 201 °C
PSA: 0.00000
LogP: 10.14650
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Specification

The Silane, methyltrioctyl-, with the CAS registry number of 3510-72-3, is also known as Methyltri-n-octylsilane and Methyltrioctylsilane. This chemical's molecular formula is C25H54Si and molecular weight is 382.78. What's more, its IUPAC name is Methyl(trioctyl)silane.

Physical properties about Silane, methyltrioctyl- are: (1)ACD/LogP: 14.00; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 13.99; (4)ACD/LogD (pH 7.4): 13.99; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 21; (12)Polar Surface Area: 0 Å2; (13)Index of Refraction: 1.443; (14)Molar Refractivity: 126.58 cm3; (15)Molar Volume: 476.9 cm3; (16)Polarizability: 50.18×10-24 cm3; (17)Surface Tension: 26.8 dyne/cm; (18)Density: 0.802 g/cm3; (19)Flash Point: 201 °C; (20)Enthalpy of Vaporization: 66 kJ/mol; (21)Boiling Point: 431 °C at 760 mmHg; (22)Vapour Pressure: 3.14E-07 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: C(CCCCCC[Si](C)(CCCCCCCC)CCCCCCCC)C
(2) InChI: InChI=1/C25H54Si/c1-5-8-11-14-17-20-23-26(4,24-21-18-15-12-9-6-2)25-22-19-16-13-10-7-3/h5-25H2,1-4H3
(3) InChIKey: BFDGJEUDNIUNFM-UHFFFAOYAL