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70411-42-6

Basic Information
CAS No.: 70411-42-6
Name: m-Aminophenyltrimethoxysilane
Article Data: 1
Molecular Structure:
Molecular Structure of 70411-42-6 (m-Aminophenyltrimethoxysilane)
Formula: C9H15NO3Si
Molecular Weight: 213.308
Synonyms: P-AMINOPHENYLTRIMETHOXYSILANE;AMINOPHENYLTRIMETHOXYSILANE;m-Aminophenyltrimethoxysilane(contains other isomers);3-(trimethoxysilyl)aniline;
EINECS: 200-258-5
Density: 1.081 g/cm3
Boiling Point: 251.206 °C at 760 mmHg
Flash Point: 105.726 °C
PSA: 53.71000
LogP: 0.93510
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Specification

The m-Aminophenyltrimethoxysilane, with the CAS registry number 70411-42-6, has the systematic name of 3-(trimethoxysilyl)aniline. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C9H15NO3Si.

The characteristics of m-Aminophenyltrimethoxysilane are as followings: (1)ACD/LogP: 0.42; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0; (4)ACD/LogD (pH 7.4): 0; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 25; (8)ACD/KOC (pH 7.4): 27; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 5; (12)Polar Surface Area: 53.71 Å2; (13)Index of Refraction: 1.502; (14)Molar Refractivity: 58.235 cm3; (15)Molar Volume: 197.308 cm3; (16)Polarizability: 23.086×10-24cm3; (17)Surface Tension: 32.977 dyne/cm; (18)Density: 1.081 g/cm3; (19)Flash Point: 105.726 °C; (20)Enthalpy of Vaporization: 48.851 kJ/mol; (21)Boiling Point: 251.206 °C at 760 mmHg; (22)Vapour Pressure: 0.021 mmHg at 25°C. 

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(C)[Si](OC)(OC)c1cc(ccc1)N
(2)InChI: InChI=1/C9H15NO3Si/c1-11-14(12-2,13-3)9-6-4-5-8(10)7-9/h4-7H,10H2,1-3H3
(3)InChIKey: YMTRNELCZAZKRB-UHFFFAOYAT