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6-Bromo-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine

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Name

6-Bromo-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine

EINECS N/A
CAS No. 321945-25-9 Density 1.67 g/cm3
PSA 63.12000 LogP 4.19520
Solubility N/A Melting Point >250 °C(Solv: pyridine (110-86-1))
Formula C13H8BrN3O2 Boiling Point N/A
Molecular Weight 318.129 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 321945-25-9 (6-Bromo-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine) Hazard Symbols N/A
Synonyms

Imidazo[1,2-a]pyridine, 6-bromo-2-(4-nitrophenyl)-

Article Data 2

6-Bromo-2-(4-nitro-phenyl)-imidazo[1,2-a]pyridine Specification

The CAS registry number of Imidazo[1,2-a]pyridine,6-bromo-2-(4-nitrophenyl)- is 321945-25-9. In addition, the molecular formula is C13H8BrN3O2 and the molecular weight is 316.98. Its systematic name is 6-bromo-2-(4-nitrophenyl)imidazo[1,2-a]pyridine. What's more, it should be stored in sealed container, and put in a cool and dry place.

Physical properties about Imidazo[1,2-a]pyridine,6-bromo-2-(4-nitrophenyl)- are: (1)ACD/LogP: 3.76; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 5; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 63.12 Å2; (7)Index of Refraction: 1.72; (8)Molar Refractivity: 75.03 cm3; (9)Molar Volume: 189.8 cm3; (10)Polarizability: 29.74 ×10-24cm3; (11)Surface Tension: 63 dyne/cm; (12)Density: 1.67 g/cm3.

You can still convert the following datas into molecular structure:
(1)SMILES: [O-][N+](=O)c3ccc(c1nc2ccc(Br)cn2c1)cc3
(2)Std. InChI: InChI=1S/C13H8BrN3O2/c14-10-3-6-13-15-12(8-16(13)7-10)9-1-4-11(5-2-9)17(18)19/h1-8H
(3)Std. InChIKey: AADWKSKCFXJLFW-UHFFFAOYSA-N

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