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CAS No.: | 6299-93-0 |
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Name: | NSC45056 |
Article Data: | 6 |
Molecular Structure: | |
Formula: | C8H9N3 |
Molecular Weight: | 147.18 |
Synonyms: | NSC45056;1H-Benzimidazol-1-amine,2-methyl-(9CI); |
Density: | 1.27 g/cm3 |
Boiling Point: | 334.9 °C at 760 mmHg |
Flash Point: | 156.3 °C |
PSA: | 43.84000 |
LogP: | 1.63970 |
The CAS register number of 2-Methylbenzoimidazol-1-amine is 6299-93-0. It also can be called as 1H-Benzimidazol-1-amine,2-methyl-(9CI) and the systematic name about this chemical is 2-methyl-1H-benzimidazol-1-amine. The molecular formula about this chemical is C8H9N3 and the molecular weight is 147.18. It belongs to the following product categorie which include Benzimidazole.
Physical properties about 2-Methylbenzoimidazol-1-amine are: (1)ACD/LogP: 1.18; (2)#H bond acceptors: 3; (3)#H bond donors: 2; (4)#Freely Rotating Bonds: 1; (5)Polar Surface Area: 21.06 Å2; (6)Index of Refraction: 1.667; (7)Molar Refractivity: 43.05 cm3; (8)Molar Volume: 115.5 cm3; (9)Polarizability: 17.06x10-24cm3; (10)Surface Tension: 49.8 dyne/cm; (11)Density: 1.27 g/cm3; (12)Flash Point: 156.3 °C; (13)Enthalpy of Vaporization: 57.79 kJ/mol; (14)Boiling Point: 334.9 °C at 760 mmHg; (15)Vapour Pressure: 0.000124 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1)SMILES: n2c1ccccc1n(c2C)N
(2)InChI: InChI=1/C8H9N3/c1-6-10-7-4-2-3-5-8(7)11(6)9/h2-5H,9H2,1H3
(3)InChIKey: LUEUYMSSSQJYBN-UHFFFAOYAR
(4)Std. InChI: InChI=1S/C8H9N3/c1-6-10-7-4-2-3-5-8(7)11(6)9/h2-5H,9H2,1H3
(5)Std. InChIKey: LUEUYMSSSQJYBN-UHFFFAOYSA-N