Products Categories
CAS No.: | 870997-87-8 |
---|---|
Name: | N-Methyl-2-aminopyridine-3-carboxamide |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C7H9N3O |
Molecular Weight: | 151.168 |
Synonyms: | 2-Amino-N-methylnicotinamide;N-Methyl-2-aminopyridine-3-carboxamide;2-amino-N-methylpyridine-3-carboxamide;3-pyridinecarboxamide, 2-amino-N-methyl-;N-Methyl-2-aminonicotinamide; |
Density: | 1.206 g/cm3 |
Boiling Point: | 373.1 °C at 760 mmHg |
Flash Point: | 179.4 °C |
PSA: | 71.50000 |
LogP: | 1.17940 |
What can I do for you?
Get Best Price
The N-Methyl-2-aminonicotinamide, with the CAS registry number 870997-87-8, has the systematic name of 2-amino-N-methylpyridine-3-carboxamide. And the molecular formula of the chemical is C7H9N3O.
The characteristics of this chemical are as followings: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.87; (4)ACD/LogD (pH 7.4): 0.93; (5)ACD/BCF (pH 5.5): 2.64; (6)ACD/BCF (pH 7.4): 3; (7)ACD/KOC (pH 5.5): 67.19; (8)ACD/KOC (pH 7.4): 76.31; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 68.01Å2; (13)Index of Refraction: 1.588; (14)Molar Refractivity: 42.2 cm3; (15)Molar Volume: 125.2 cm3; (16)Polarizability: 16.73×10-24cm3; (17)Surface Tension: 54.4 dyne/cm; (18)Density: 1.206 g/cm3; (19)Flash Point: 179.4 °C; (20)Enthalpy of Vaporization: 62.03 kJ/mol; (21)Boiling Point: 373.1 °C at 760 mmHg; (22)Vapour Pressure: 9.19E-06 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: O=C(NC)c1cccnc1N
(2)InChI: InChI=1/C7H9N3O/c1-9-7(11)5-3-2-4-10-6(5)8/h2-4H,1H3,(H2,8,10)(H,9,11)
(3)InChIKey: KOAUKLIDSVHLCP-UHFFFAOYAJ