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| CAS No.: | 69825-84-9 |
|---|---|
| Name: | 3H-Imidazo[4,5-b]pyridin-5-amine |
| Molecular Structure: | |
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| Formula: | C6H6N4 |
| Molecular Weight: | 134.14 |
| Synonyms: | 1H-Imidazo[4,5-b]pyridine, 5-amino- (7CI);NSC 289630; |
| Density: | 1.481 g/cm3 |
| Boiling Point: | 484.301 °C at 760 mmHg |
| Flash Point: | 278.435 °C |
| PSA: | 67.59000 |
| LogP: | 1.12130 |
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- Total:21 Page 1 of 1 1
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Specification
5-Aminoimidazo[4,5-b]pyridine, with the CAS registry number 69825-84-9, is also named as 1H-Imidazo[4,5-b]pyridine, 5-amino- (7CI). This chemical's molecular formula is C6H6N4 and molecular weight is 134.14. What's more, its systematic name is 1H-Imidazo[4,5-b]pyridin-5-amine.
Physical properties of 5-Aminoimidazo[4,5-b]pyridine are: (1)ACD/LogP: 0.588; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.61; (4)ACD/LogD (pH 7.4): -0.10; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.00; (8)ACD/KOC (pH 7.4): 10.27; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 67.59 Å2; (13)Index of Refraction: 1.806; (14)Molar Refractivity: 38.947 cm3; (15)Molar Volume: 90.599 cm3; (16)Polarizability: 15.44×10-24cm3; (17)Surface Tension: 97.7 dyne/cm; (18)Density: 1.481 g/cm3; (19)Flash Point: 278.435 °C; (20)Enthalpy of Vaporization: 74.957 kJ/mol; (21)Boiling Point: 484.301 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: n1c(ccc2c1ncn2)N
(2)Std. InChI: InChI=1S/C6H6N4/c7-5-2-1-4-6(10-5)9-3-8-4/h1-3H,(H3,7,8,9,10)
(3)Std. InChIKey: WEJDQDKMUXUQJJ-UHFFFAOYSA-N