CAS No.1026201-45-5,8-bromoimidazo[1,2-a]pyridine-2-carboxylic acid Suppliers

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Basic Information

Molecular Structure:
CAS No.:	1026201-45-5
Name:	8-bromoimidazo[1,2-a]pyridine-2-carboxylic acid
Article Data:	2

Formula:	C₈H₅BrN₂O₂
Molecular Weight:	241.04
Synonyms:	8-Bromo-imidazo[1,2-a]pyridine-2-carboxylic acid;8-Bromoimidazo[1,2-a]pyridine-2-carboxylic acid;
Density:	1.899 g/cm³
PSA:	54.60000
LogP:	1.79500

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Specification

The Imidazo[1,2-a]pyridine-2-carboxylic acid, 8-bromo-, with the CAS registry number 1026201-45-5, is also known as 8-Bromo-imidazo[1,2-a]pyridine-2-carboxylic acid. This chemical's molecular formula is C₈H₅BrN₂O₂ and molecular weight is 241.04. What's more, its systematic name is 8-Bromoimidazo[1,2-a]pyridine-2-carboxylic acid.

Physical properties of Imidazo[1,2-a]pyridine-2-carboxylic acid, 8-bromo- are: (1)ACD/LogP: 2.22; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 4; (8)#H bond donors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 54.6 Å²; (11)Index of Refraction: 1.728; (12)Molar Refractivity: 50.583 cm³; (13)Molar Volume: 126.935 cm³; (14)Polarizability: 20.053×10^-24cm³; (15)Surface Tension: 66.435 dyne/cm; (16)Density: 1.899 g/cm³.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: C1=CN2C=C(N=C2C(=C1)Br)C(=O)O
(2)InChI: InChI=1S/C8H5BrN2O2/c9-5-2-1-3-11-4-6(8(12)13)10-7(5)11/h1-4H,(H,12,13)
(3)InChIKey: OREYKECANVXONJ-UHFFFAOYSA-N