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18081-89-5

Basic Information
CAS No.: 18081-89-5
Name: BENZYL-PYRIDIN-2-YLMETHYL-AMINE
Article Data: 37
Molecular Structure:
Molecular Structure of 18081-89-5 (BENZYL-PYRIDIN-2-YLMETHYL-AMINE)
Formula: C13H14N2
Molecular Weight: 198.268
Synonyms: Pyridine,2-[(benzylamino)methyl]- (6CI,8CI);N-Benzyl-2-pyridinemethanamine;N-Benzyl-N-(2-pyridylmethyl)amine;
EINECS: 242-092-7
Density: 1.071 g/cm3
Boiling Point: 313.1 °C at 760 mmHg
Flash Point: 143.2 °C
Hazard Symbols: IrritantXi
PSA: 24.92000
LogP: 2.76230
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Specification

The 2-Pyridinemethanamine,N-(phenylmethyl)- is an organic compound with the formula C13H14N2. The systematic name of this chemical is 1-Phenyl-N-(pyridin-2-ylmethyl)methanamine. With the CAS registry number 18081-89-5, it is also named as Benzylpyridin-2-ylmethylamine. Besides, its molecular weight is 198.26.

The physical properties of 2-Pyridinemethanamine,N-(phenylmethyl)- are: (1)ACD/LogP: 1.93; (2)#H bond acceptors: 2; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 4; (5)Polar Surface Area: 16.13 Å2; (6)Index of Refraction: 1.584; (7)Molar Refractivity: 61.97 cm3; (8)Molar Volume: 184.9 cm3; (9)Polarizability: 24.56×10-24 cm3; (10)Surface Tension: 44.6 dyne/cm; (11)Density: 1.071 g/cm3; (12)Flash Point: 143.2 °C; (13)Enthalpy of Vaporization: 55.42 kJ/mol; (14)Boiling Point: 313.1 °C at 760 mmHg; (15)Vapour Pressure: 0.000507 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: n1ccccc1CNCc2ccccc2
(2)InChI: InChI=1/C13H14N2/c1-2-6-12(7-3-1)10-14-11-13-8-4-5-9-15-13/h1-9,14H,10-11H2
(3)InChIKey: RRLRWANEZGPBAD-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C13H14N2/c1-2-6-12(7-3-1)10-14-11-13-8-4-5-9-15-13/h1-9,14H,10-11H2
(5)Std. InChIKey: RRLRWANEZGPBAD-UHFFFAOYSA-N