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CAS No.: | 1033202-04-8 |
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Name: | 8-Hydroxyimidazo[1,2-a]pyridine-3-carbaldehyde |
Molecular Structure: | |
Formula: | C8H6N2O2 |
Molecular Weight: | 162.15 |
Synonyms: | 8-Hydroxyimidazo[1,2-a]pyridine-3-carbaldehyde; |
Density: | 1.418 g/cm3 |
PSA: | 54.60000 |
LogP: | 0.85240 |
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The Imidazo[1,2-a]pyridine-3-carboxaldehyde, 8-hydroxy- has the CAS registry number 1033202-04-8. This chemical's molecular formula is C8H6N2O2 and molecular weight is 162.15. What's more, its systematic name is 8-Hydroxyimidazo[1,2-a]pyridine-3-carbaldehyde.
Physical properties of Imidazo[1,2-a]pyridine-3-carboxaldehyde, 8-hydroxy- are: (1)ACD/LogP: 0.93; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.81; (4)ACD/LogD (pH 7.4): 0.693; (5)ACD/BCF (pH 5.5): 2.278; (6)ACD/BCF (pH 7.4): 1.741; (7)ACD/KOC (pH 5.5): 58.16; (8)ACD/KOC (pH 7.4): 44.439; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 54.6 Å2; (13)Index of Refraction: 1.676; (14)Molar Refractivity: 43.026 cm3; (15)Molar Volume: 114.315 cm3; (16)Polarizability: 17.057×10-24 cm3; (17)Surface Tension: 60.522 dyne/cm; (18)Density: 1.418 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(c2ncc(n2c1)C=O)O
(2)InChI: InChI=1S/C8H6N2O2/c11-5-6-4-9-8-7(12)2-1-3-10(6)8/h1-5,12H
(3)InChIKey: WIVSAAVIODAVRH-UHFFFAOYSA-N