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857284-05-0

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Basic Information
CAS No.: 857284-05-0
Name: METHYL-(2-PYRIDIN-3-YL-BENZYL)-AMINE
Molecular Structure:
Molecular Structure of 857284-05-0 (METHYL-(2-PYRIDIN-3-YL-BENZYL)-AMINE)
Formula: C13H14N2
Molecular Weight: 198.26
Synonyms: Methyl-(2-pyridin-3-yl-benzyl)-amine;
Density: 1.045 g/cm3
Boiling Point: 344.4 °C at 760 mmHg
Flash Point: 162.1 °C
Risk Codes: 34
Safety: 26-36/37/39
PSA: 24.92000
LogP: 2.85890
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Specification

The Benzenemethanamine,N-methyl-2-(3-pyridinyl)-, with the CAS registry number 857284-05-0, is also known as Methyl-(2-pyridin-3-yl-benzyl)-amine. It belongs to the product categories of Pharmacetical. This chemical's molecular formula is C13H14N2 and molecular weight is 198.26. What's more, both its IUPAC name and systematic name are the same which is called N-Methyl-1-(2-pyridin-3-ylphenyl)methanamine.

Physical properties about Benzenemethanamine,N-methyl-2-(3-pyridinyl)- are: (1) ACD/LogP: 1.96; (2) # of Rule of 5 Violations: 0; (3) #H bond acceptors: 2; (4) #H bond donors: 1; (5) #Freely Rotating Bonds: 3; (6) Polar Surface Area: 16.13 Å2; (7) Index of Refraction: 1.568; (8) Molar Refractivity: 62.08 cm3; (9) Molar Volume: 189.5 cm3; (10) Surface Tension: 40.8 dyne/cm; (11) Density: 1.045 g/cm3; (12) Flash Point: 162.1 °C; (13) Enthalpy of Vaporization: 58.83 kJ/mol; (14) Boiling Point: 344.4 °C at 760 mmHg; (15) Vapour Pressure: 6.61E-05 mmHg at 25 °C.

When you are dealing with this chemical, you should be very careful. This chemical may cause burns. Therefore, you should wear suitable protective clothing, gloves and eye/face protection. And in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1) SMILES: n2cccc(c1c(cccc1)CNC)c2
(2) InChI: InChI=1/C13H14N2/c1-14-9-11-5-2-3-7-13(11)12-6-4-8-15-10-12/h2-8,10,14H,9H2,1H3
(3) InChIKey: HEJTYMMYWPZKIZ-UHFFFAOYAH