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45815-08-5

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Basic Information
CAS No.: 45815-08-5
Name: 2-(Propylamino)pyridine
Article Data: 13
Molecular Structure:
Molecular Structure of 45815-08-5 (2-(Propylamino)pyridine)
Formula: C8H12N2
Molecular Weight: 136.197
Synonyms: N-propylpyridin-2-amine
Density: 1.007 g/cm3
Boiling Point: 236.056 °C at 760 mmHg
Flash Point: 96.564 °C
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Specification

The 2-(Propylamino)pyridine, with the CAS registry number 45815-08-5, is also known as 2-Pyridinamine, N-propyl-. This chemical's molecular formula is C8H12N2 and molecular weight is 136.19. Its systematic name is called N-propylpyridin-2-amine.

Physical properties of 2-(Propylamino)pyridine: (1)ACD/LogP: 2.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1; (4)ACD/LogD (pH 7.4): 2; (5)ACD/BCF (pH 5.5): 3; (6)ACD/BCF (pH 7.4): 22; (7)ACD/KOC (pH 5.5): 38; (8)ACD/KOC (pH 7.4): 312; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Index of Refraction: 1.553; (13)Molar Refractivity: 43.219 cm3; (14)Molar Volume: 135.127 cm3; (15)Surface Tension: 40.026 dyne/cm; (16)Density: 1.008 g/cm3; (17)Flash Point: 96.564 °C; (18)Enthalpy of Vaporization: 47.284 kJ/mol; (19)Boiling Point: 236.056 °C at 760 mmHg; (20)Vapour Pressure: 0.048 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: CCCNc1ccccn1
(2)InChI: InChI=1/C8H12N2/c1-2-6-9-8-5-3-4-7-10-8/h3-5,7H,2,6H2,1H3,(H,9,10)
(3)InChIKey: GIKNJMSYQSDBRR-UHFFFAOYAX