Imidazo[1,2-a]pyridine-2-carboxylicacid, 6-bromo-, ethyl ester (67625-37-0)

The Ethyl 6-bromoimidazo[1,2-a]pyridine-2-carboxylate, with the cas registry number 67625-37-0, has the systematic name of ethyl 6-bromoimidazo[1,2-a]pyridine-2-carboxylate. It belongs to the following product categories: Blocks; Bromides; Imidazoles; Pyridines; Esters; Fused Ring Systems. And the molecular formula of the chemical is C₁₀H₉BrN₂O₂.

The characteristics of this chemical are as followings: (1)ACD/LogP: 2.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.61; (4)ACD/LogD (pH 7.4): 2.61; (5)ACD/BCF (pH 5.5): 56.22; (6)ACD/BCF (pH 7.4): 56.23; (7)ACD/KOC (pH 5.5): 622.54; (8)ACD/KOC (pH 7.4): 622.61; (9)#H bond acceptors: 4; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 43.6 Å²; (13)Index of Refraction: 1.637; (14)Molar Refractivity: 60.15 cm³; (15)Molar Volume: 167.5 cm³; (16)Polarizability: 23.8×10^-24cm³; (17)Surface Tension: 50 dyne/cm.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: Brc1cn2cc(nc2cc1)C(=O)OCC
(2)InChI: InChI=1/C10H9BrN2O2/c1-2-15-10(14)8-6-13-5-7(11)3-4-9(13)12-8/h3-6H,2H2,1H3
(3)InChIKey: MWDCKDQQAFZDOH-UHFFFAOYAN