5-Bromo-1H-imidazo[4,5-b]pyridine supplier

Name
1H-Imidazo[4,5-b]pyridine,5-bromo-(8CI)
EINECS
CAS No. 28279-52-9
Article Data2
CAS DataBase
Density 1.894 g/cm³
Solubility
Melting Point
Formula C₆H₄BrN₃
Boiling Point 442.5 °C at 760 mmHg
Molecular Weight 198.022
Flash Point 221.4 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 1H-Imidazo[4,5-b]pyridine,5-bromo- (8CI);5-Bromo-1H-imidazo[4,5-b]pyridine;5-Bromo-4-azabenzimidazole;
PSA 41.57000
LogP 1.72040

5-Bromo-1H-imidazo[4,5-b]pyridine Specification

The 5-Bromo-1H-imidazo[4,5-b]pyridine, with CAS registry number 28279-52-9, belongs to the following product categories: Pyridine; Chiral Chemicals. It has the systematic name of 5-bromo-1H-imidazo[4,5-b]pyridine. And the chemical formula of this chemical is C₆H₄BrN₃.

Physical properties of 5-Bromo-1H-imidazo[4,5-b]pyridine: (1)ACD/LogP: 1.07; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.04; (4)ACD/LogD (pH 7.4): 1.06; (5)#H bond acceptors: 3; (6)#H bond donors: 1; (7)#Freely Rotating Bonds: 0; (8)Polar Surface Area: 41.57 Å²; (9)Index of Refraction: 1.745; (10)Molar Refractivity: 42.4 cm³; (11)Molar Volume: 104.5 cm³; (12)Polarizability: 16.8×10^-24cm³; (13)Surface Tension: 76.9 dyne/cm; (14)Density: 1.894 g/cm³; (15)Flash Point: 221.4 °C; (16)Enthalpy of Vaporization: 67.3 kJ/mol; (17)Boiling Point: 442.5 °C at 760 mmHg; (18)Vapour Pressure: 1.3E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(nc2c1[nH]cn2)Br
(2)InChI: InChI=1/C6H4BrN3/c7-5-2-1-4-6(10-5)9-3-8-4/h1-3H,(H,8,9,10)
(3)InChIKey: INKJIWXVLWIENL-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C6H4BrN3/c7-5-2-1-4-6(10-5)9-3-8-4/h1-3H,(H,8,9,10)
(5)Std. InChIKey: INKJIWXVLWIENL-UHFFFAOYSA-N

Product Name

1H-Imidazo[4,5-b]pyridine,5-bromo-(8CI)

5-Bromo-1H-imidazo[4,5-b]pyridine Specification

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