Basic Information | Post buying leads | Suppliers | Cas Database |
Name |
6-Bromoimidazo[1,2-a]pyridine-8-carboxylic acid |
EINECS | N/A |
CAS No. | 903129-78-2 | Density | 1.899 g/cm3 |
PSA | 54.60000 | LogP | 1.79500 |
Solubility | N/A | Melting Point |
N/A |
Formula | C8H5BrN2O2 | Boiling Point | N/A |
Molecular Weight | 241.04 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | 36/37 | Risk Codes | 43 |
Molecular Structure | Hazard Symbols | Xi | |
Synonyms |
Imidazo[1,2-a]pyridine-8-carboxylic acid, 6-bromo-;6-bromo-1H-imidazo[1,2-a]pyridine-8-carboxylic acid;Bromoimidazopyridinecarboxylic acid;MFCD08448156; |
Article Data | 3 |
The 6-Bromoimidazo[1,2-a]pyridine-8-carboxylic acid, with the CAS registry number 903129-78-2, is also called Imidazo[1,2-a]pyridine-8-carboxylic acid, 6-bromo-, or Bromoimidazopyridinecarboxylic acid. And the molecular formula of the chemical is C8H5BrN2O2.
The characteristics of 6-Bromoimidazo[1,2-a]pyridine-8-carboxylic acid are as followings: (1)ACD/LogP: 2.38; (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.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: c1cn2cc(cc(c2n1)C(=O)O)Br
(2)InChI: InChI=1/C8H5BrN2O2/c9-5-3-6(8(12)13)7-10-1-2-11(7)4-5/h1-4H,(H,12,13)
(3)InChIKey: XPFDJWFDQORPQO-UHFFFAOYAY