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CAS No.: | 518285-55-7 |
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Name: | (5-Methyl-pyridin-2-yl)-piperidin-4-yl-amine |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C11H17N3 |
Molecular Weight: | 191.276 |
Synonyms: | (5-METHYL-PYRIDIN-2-YL)-PIPERIDIN-4-YL-AMINE |
Density: | 1.081 g/cm 3 |
Boiling Point: | 339.8 °C at 760 mmHg |
Flash Point: | 159.3 °C |
PSA: | 36.95000 |
LogP: | 3.55970 |
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This chemical is called (5-Methyl-pyridin-2-yl)-piperidin-4-yl-amine, and it can also be named as 2-pyridinamine, 5-methyl-N-4-piperidinyl-. With the molecular formula of C11H17N3, its molecular weight is 191.28. The CAS registry number of this chemical is 518285-55-7.
Other characteristics of the (5-Methyl-pyridin-2-yl)-piperidin-4-yl-amine can be summarised as followings: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 3; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 36.95 Å2; (11)Index of Refraction: 1.576; (12)Molar Refractivity: 58.54 cm3; (13)Molar Volume: 176.9 cm3; (14)Polarizability: 23.21×10-24cm3; (15)Surface Tension: 44.9 dyne/cm; (16)Density: 1.081 g/cm3; (17)Flash Point: 159.3 °C; (18)Enthalpy of Vaporization: 58.33 kJ/mol; (19)Boiling Point: 339.8 °C at 760 mmHg; (20)Vapour Pressure: 8.95E-05 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Cc1ccc(nc1)NC2CCNCC2
2.InChI: InChI=1/C11H17N3/c1-9-2-3-11(13-8-9)14-10-4-6-12-7-5-10/h2-3,8,10,12H,4-7H2,1H3,(H,13,14)
3.InChIKey: ZHESHQYMQHBMLD-UHFFFAOYAK