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886851-41-8

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Basic Information
CAS No.: 886851-41-8
Name: N-Methyl-(6-thien-2-ylpyrid-3-yl)methylamine
Molecular Structure:
Molecular Structure of 886851-41-8 (N-Methyl-(6-thien-2-ylpyrid-3-yl)methylamine)
Formula: C11H12N2S
Molecular Weight: 204.29138
Synonyms: N-Methyl-(6-thien-2-ylpyrid-3-yl)methylamine;5-[(Methylamino)methyl]-2-thien-2-ylpyridine;5-[(Methylamino)methyl]-2-thien-2-ylpyridine 97%;N-Methyl-1-[6-(thien-2-yl)pyridin-3-yl]methylamine
Density: 1.14g/cm3
Melting Point: 65.5 °C
Boiling Point: 325.7 °C at 760 mmHg
Flash Point: 150.8 °C
Hazard Symbols: CorrosiveC
PSA: 53.16000
LogP: 2.92040
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Specification

The 3-Pyridinemethanamine,N-methyl-6-(2-thienyl)-, with CAS registry number 886851-41-8, has the systematic name of N-methyl-1-[6-(2-thienyl)-3-pyridyl]methanamine. Besides this, it is also called N-Methyl-(6-thien-2-ylpyrid-3-yl)methylamine. And the chemical formula of this chemical is C11H12N2S.

Physical properties of 3-Pyridinemethanamine,N-methyl-6-(2-thienyl)-: (1)ACD/LogP: 1.74; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 7.4): 0.69; (4)#H bond acceptors: 2; (5)#H bond donors: 1; (6)#Freely Rotating Bonds: 3; (7)Polar Surface Area: 53.16 Å2; (8)Index of Refraction: 1.59; (9)Molar Refractivity: 60.46 cm3; (10)Molar Volume: 179 cm3; (11)Polarizability: 23.97×10-24cm3; (12)Surface Tension: 44.5 dyne/cm; (13)Density: 1.14 g/cm3; (14)Flash Point: 150.8 °C; (15)Enthalpy of Vaporization: 56.79 kJ/mol; (16)Boiling Point: 325.7 °C at 760 mmHg; (17)Vapour Pressure: 0.000226 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CNCc1ccc(nc1)c2cccs2
(2)InChI: InChI=1/C11H12N2S/c1-12-7-9-4-5-10(13-8-9)11-3-2-6-14-11/h2-6,8,12H,7H2,1H3
(3)InChIKey: LFZDJRPWILOVEO-UHFFFAOYAQ
(4)Std. InChI: InChI=1S/C11H12N2S/c1-12-7-9-4-5-10(13-8-9)11-3-2-6-14-11/h2-6,8,12H,7H2,1H3
(5)Std. InChIKey: LFZDJRPWILOVEO-UHFFFAOYSA-N