2-(4-BROMO-PHENYL)-1H-IMIDAZO[4,5-C]PYRIDINE
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2-(4-BROMO-PHENYL)-1H-IMIDAZO[4,5-C]PYRIDINE
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CAS No:
113270-73-8
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Formula:
C12H8BrN3
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Chemical Name:
2-(4-BROMO-PHENYL)-1H-IMIDAZO[4,5-C]PYRIDINE
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Synonyms:
2-(4-Bromophenyl)-1H-imidazo[4,5-c]pyridine;2-(4-BROMO-PHENYL)-1H-IMIDAZO[4,5-C]PYRIDINE;2-(4-bromophenyl)-3H-imidazo[4,5-c]pyridine;3H-Imidazo[4,5-c]pyridine,2-(4-bromophenyl)-;ACMC-20a0vd;SCHEMBL5591256;CTK4A8185;DTXSID10530141;KS-000024JB;ANW-52055
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CAS No:
2-(4-BROMO-PHENYL)-1H-IMIDAZO[4,5-C]PYRIDINE Basic Attributes
274.11602
272.99000
DTXSID10530141
2933990090
Characteristics
41.6
2.8
1.614±0.06 g/cm3(Predicted)
465.6±51.0 °C(Predicted)
235.4ºC
1.719
7.61E-09mmHg at 25°C
2-(4-BROMO-PHENYL)-1H-IMIDAZO[4,5-C]PYRIDINE Use and Manufacturing
2-(4-Bromo-phenyl)-3H-imidazo[4, 5-c]pyridine (Preparation 12A) (0.25 g, 0.912 mmol), 4-methoxyphenylborrhonic acid (0.20 g, 1.32 mmol), tetrakis(triphenylphosphine)palladium (0) and potassium carbonate (0.126 g, 2.32 mmol) in ethanol/water (13 mL/1.5 mL) were refluxed for 2.5h. The mixture was diluted with ethanol (20 mL) and water (20 mL), filtered (Celite) and concentrated. The residue was triturated with saturated aq. NaHCO3 (20 mL), water and ether (50 mL) to give 0.26 g (95%) of 2-(4'- methoxy-biphenyl-4-yl)-3H-imidazo[4, 5-c]pyridine as a light pink-tan tietated solid which had: mp > 2600C; NMR (DMSO-d6) delta 8.90 (s, 1 H), 8.26 (d, J = 5.4 Hz, , 1 H), 8.22 (d, J = 8.7 Hz, 2H), 7.81 (d, J = 8.7 Hz, 2H), 7.70 (d, J = 9.1 Hz, 2H), 7.55 (d, J = 5.4 Hz, 1 H), 7.02 (J = 8.7 Hz, 2H), 3.77 (S, 3H).
Computed Properties
Molecular Weight:274.12
XLogP3:2.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:272.99016
Monoisotopic Mass:272.99016
Topological Polar Surface Area:41.6
Heavy Atom Count:16
Complexity:240
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
2-(4-BROMO-PHENYL)-1H-IMIDAZO[4,5-C]PYRIDINE
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