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8-Bromo-6-methylimidazo[1,2-a]pyridine

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Name

8-Bromo-6-methylimidazo[1,2-a]pyridine

EINECS N/A
CAS No. 136117-93-6 Density 1.6 g/cm3
PSA 17.30000 LogP 2.40520
Solubility N/A Melting Point N/A
Formula C8H7BrN2 Boiling Point N/A
Molecular Weight 211.061 Flash Point N/A
Transport Information N/A Appearance N/A
Safety Risk Codes  Xi:Irritant;
Molecular Structure Molecular Structure of 136117-93-6 (8-Bromo-6-methylimidazo[1,2-a]pyridine) Hazard Symbols Xi
Synonyms

8-bromo-6-methylimidazo[1,2-a]pyridine;imidazo[1,2-a]pyridine, 8-bromo-6-methyl-;

Article Data 3

8-Bromo-6-methylimidazo[1,2-a]pyridine Specification

The 8-Bromo-6-methylimidazo[1,2-a]pyridine, with the CAS registry number 136117-93-6, is also called imidazo[1,2-a]pyridine, 8-bromo-6-methyl-. It belongs to the following product categories: Blocks; Bromides; Imidazoles; Pyridines. And the molecular formula of the chemical is C8H7BrN2.

The characteristics of 8-Bromo-6-methylimidazo[1,2-a]pyridine are as followings: (1)ACD/LogP: 2.23; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.21; (4)ACD/LogD (pH 7.4): 2.23; (5)ACD/BCF (pH 5.5): 28.05; (6)ACD/BCF (pH 7.4): 29.29; (7)ACD/KOC (pH 5.5): 373.79; (8)ACD/KOC (pH 7.4): 390.34; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 17.3 Å2; (13)Index of Refraction: 1.663; (14)Molar Refractivity: 48.69 cm3; (15)Molar Volume: 131.3 cm3; (16)Polarizability: 19.3×10-24cm3; (17)Surface Tension: 46.7 dyne/cm; (18)Density: 1.6 g/cm3

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Cc1cn2ccnc2c(Br)c1
(2)InChI: InChI=1/C8H7BrN2/c1-6-4-7(9)8-10-2-3-11(8)5-6/h2-5H,1H3
(3)InChIKey: IEXMXPBKRWDOBC-UHFFFAOYAA

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