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Basic Information
CAS No.: 69875-89-4
Name: BENZYL-(2-METHOXY-BENZYL)-AMINE
Article Data: 9
Molecular Structure:
Molecular Structure of 69875-89-4 (BENZYL-(2-METHOXY-BENZYL)-AMINE)
Formula: C15H17NO
Molecular Weight: 227.306
Synonyms: N-(2-Methoxybenzyl)benzylamine;NSC 128933;N-[(2-methoxyphenyl)methyl]-1-phenylmethanamine;N-benzyl-1-(2-methoxyphenyl)methanamine;benzenemethanamine, 2-methoxy-N-(phenylmethyl)-;N-Benzyl-1-(2-methoxyphenyl)methanamine;
Density: 1.053 g/cm3
Boiling Point: 335.7 °C at 760 mmHg
Flash Point: 139.8 °C
Hazard Symbols: Xi
PSA: 21.26000
LogP: 3.37590
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Specification

The Benzenemethanamine,2-methoxy-N-(phenylmethyl)-, with the CAS registry number 69875-89-4, has the systematic name of N-benzyl-1-(2-methoxyphenyl)methanamine. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C15H17NO.

The characteristics of Benzenemethanamine,2-methoxy-N-(phenylmethyl)- are as followings: (1)ACD/LogP: 3.34; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 5; (6)Polar Surface Area: 12.47 Å2; (7)Index of Refraction: 1.567; (8)Molar Refractivity: 70.56 cm3; (9)Molar Volume: 215.7 cm3; (10)Polarizability: 27.97×10-24cm3; (11)Surface Tension: 39.4 dyne/cm; (12)Density: 1.053 g/cm3; (13)Flash Point: 139.8 °C; (14)Enthalpy of Vaporization: 57.87 kJ/mol; (15)Boiling Point: 335.7 °C at 760 mmHg; (16)Vapour Pressure: 0.000118 mmHg at 25°C.  

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O(c1ccccc1CNCc2ccccc2)C
(2)InChI: InChI=1/C15H17NO/c1-17-15-10-6-5-9-14(15)12-16-11-13-7-3-2-4-8-13/h2-10,16H,11-12H2,1H3
(3)InChIKey: XIRPWRHFPWEBHP-UHFFFAOYAB