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CAS No.: | 133427-08-4 |
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Name: | IMIDAZO[1,2-A]PYRIDINE-8-CARBOXYLIC ACID |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C8H6N2O2 |
Molecular Weight: | 162.15 |
Synonyms: | IMIDAZO[1,2-A]PYRIDINE-8-CARBOXYLIC ACID;H-imidazo[1,2-a]pyridine-8-carboxylic acid;Imidazo[1,2-a]pyridine-8-...;IMidazo[1,2-a]pyridin-8-carboxylic acid;H-iMidazo[1,2-a]pyridine-8-carbo×ylic acid |
Density: | 1.418 g/cm3 |
Hazard Symbols: | Xn |
Risk Codes: | 22-43 |
Safety: | 36/37 |
PSA: | 54.60000 |
LogP: | 1.03250 |
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The Imidazo[1,2-a]pyridine-8-carboxylicacid, with CAS registry number 133427-08-4, belongs to the following product category: Chiral Chemicals. It has the systematic name of imidazo[1,2-a]pyridine-8-carboxylic acid. And the chemical formula of this chemical is C8H6N2O2.
Physical properties of Imidazo[1,2-a]pyridine-8-carboxylicacid: (1)ACD/LogP: 1.32; (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: 1.676; (12)Molar Refractivity: 43.026 cm3; (13)Molar Volume: 114.315 cm3; (14)Polarizability: 17.057×10-24cm3; (15)Surface Tension: 60.522 dyne/cm; (16)Density: 1.418 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(c2nccn2c1)C(=O)O
(2)InChI: InChI=1/C8H6N2O2/c11-8(12)6-2-1-4-10-5-3-9-7(6)10/h1-5H,(H,11,12)
(3)InChIKey: WHOCKNWCRFHEMH-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C8H6N2O2/c11-8(12)6-2-1-4-10-5-3-9-7(6)10/h1-5H,(H,11,12)
(5)Std. InChIKey: WHOCKNWCRFHEMH-UHFFFAOYSA-N