The 2-Methylaminopyridine-3-carbaldehyde, with the CAS registry number 32399-08-9, is also known as 2-(Methylamino)nicotinaldehyde. This chemical's molecular formula is C7H8N2O and molecular weight is 136.15. Its systematic name is called 2-(methylamino)pyridine-3-carbaldehyde.
Physical properties of 2-Methylaminopyridine-3-carbaldehyde: (1)ACD/LogP: 1.34; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.14; (4)ACD/LogD (pH 7.4): 1.34; (5)ACD/BCF (pH 5.5): 3.91; (6)ACD/BCF (pH 7.4): 6.12; (7)ACD/KOC (pH 5.5): 81.14; (8)ACD/KOC (pH 7.4): 126.98; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Index of Refraction: 1.634; (13)Molar Refractivity: 40.7 cm3; (14)Molar Volume: 113.7 cm3; (15)Surface Tension: 51.8 dyne/cm; (16)Density: 1.196 g/cm3; (17)Flash Point: 124.2 °C; (18)Enthalpy of Vaporization: 52.05 kJ/mol; (19)Boiling Point: 281.7 °C at 760 mmHg; (20)Vapour Pressure: 0.00351 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cccnc1NC
(2)InChI: InChI=1/C7H8N2O/c1-8-7-6(5-10)3-2-4-9-7/h2-5H,1H3,(H,8,9)
(3)InChIKey: HLHGWWKGIQXCKA-UHFFFAOYAD
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