This chemical is called 2-(Dimethylamino)pyrimidine-4-carboxaldehyde, and its systematic name is 4-Pyrimidinecarboxaldehyde, 2-(dimethylamino)-. With the molecular formula of C7H9N3O, its molecular weight is 151.17. The CAS registry number of this chemical is 872707-78-3.
Other characteristics of the 2-(Dimethylamino)pyrimidine-4-carboxaldehyde can be summarised as followings: (1)ACD/LogP: 0.49; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.49; (4)ACD/LogD (pH 7.4): 0.49 ; (5)#H bond acceptors: 4; (6)#H bond donors: 0; (7)#Freely Rotating Bonds: 2; (8)Polar Surface Area: 46.09 Å2; (9)Index of Refraction: 1.609; (10)Molar Refractivity: 43.5 cm3; (11)Molar Volume: 125.5 cm3; (12)Polarizability: 17.24×10-24cm3; (13)Surface Tension: 55.5 dyne/cm; (14)Density: 1.204 g/cm3; (15)Flash Point: 128.9 °C; (16)Enthalpy of Vaporization: 52.89 kJ/mol; (17)Boiling Point: 289.6 °C at 760 mmHg; (18)Vapour Pressure: 0.00218 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: CN(C)c1nc(C=O)ccn1
2.InChI: InChI=1/C7H9N3O/c1-10(2)7-8-4-3-6(5-11)9-7/h3-5H,1-2H3
3.InChIKey: AAWOFXAPUNJIHA-UHFFFAOYAX
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