3H-Imidazo[4,5-b]pyridine supplier

Name
3H-Imidazo[4,5-b]pyridine
EINECS 205-987-3
CAS No. 170245-18-8
Density 1.348 g/cm³
Solubility
Melting Point 147-150℃
Formula C₆H₅N₃
Boiling Point 395.3 °C at 760 mmHg
Molecular Weight 119.12
Flash Point 207.2 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 7-Azabenzimidazole;4-Azabenzimidazole;3,4-Diazaindole;
PSA 41.57000
LogP 0.95790

3H-Imidazo[4,5-b]pyridine Specification

The 3H-Imidazo[4,5-b]pyridine, with the CAS registry number 170245-18-8, is also known as 7-Azabenzimidazole. It belongs to the product category of Pyridine. This chemical's molecular formula is C₆H₅N₃ and molecular weight is 119.12. Its IUPAC name is called 1H-imidazo[4,5-b]pyridine.

Physical properties of 3H-Imidazo[4,5-b]pyridine: (1)ACD/LogP: 0.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -0.39; (4)ACD/LogD (pH 7.4): 0.28; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 7.03; (8)ACD/KOC (pH 7.4): 33.01; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Index of Refraction: 1.715; (13)Molar Refractivity: 34.71 cm³; (14)Molar Volume: 88.3 cm³; (15)Surface Tension: 73.9 dyne/cm; (16)Density: 1.348 g/cm³; (17)Flash Point: 207.2 °C; (18)Enthalpy of Vaporization: 62.02 kJ/mol; (19)Boiling Point: 395.3 °C at 760 mmHg; (20)Vapour Pressure: 4.24E-06 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CC2=C(N=C1)N=CN2
(2)InChI: InChI=1S/C6H5N3/c1-2-5-6(7-3-1)9-4-8-5/h1-4H,(H,7,8,9)
(3)InChIKey: GAMYYCRTACQSBR-UHFFFAOYSA-N

Product Name

3H-Imidazo[4,5-b]pyridine

3H-Imidazo[4,5-b]pyridine Specification

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