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| CAS No.: | 30489-43-1 |
|---|---|
| Name: | IMIDAZO[1,2-A]PYRIDIN-3-YLMETHANOL |
| Article Data: | 8 |
| Molecular Structure: | |
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| Formula: | C8H8N2O |
| Molecular Weight: | 148.16 |
| Synonyms: | Imidazo[1,2-a]pyridin-3-ylmethanol;3-(Hydroxymethyl)imidazo[1,2-a]pyridine; |
| Density: | 1.267 g/cm3 |
| PSA: | 37.53000 |
| LogP: | 0.82660 |
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Specification
The Imidazo[1,2-a]pyridine-3-methanol, with the CAS registry number 30489-43-1, is also known as 3-(Hydroxymethyl)imidazo[1,2-a]pyridine. This chemical's molecular formula is C8H8N2O and molecular weight is 148.16. What's more, its systematic name is Imidazo[1,2-a]pyridin-3-ylmethanol.
Physical properties of Imidazo[1,2-a]pyridine-3-methanol are: (1)ACD/LogP: 0.166; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.22; (4)ACD/LogD (pH 7.4): 0.05; (5)ACD/BCF (pH 5.5): 1.00; (6)ACD/BCF (pH 7.4): 1.00; (7)ACD/KOC (pH 5.5): 1.20; (8)ACD/KOC (pH 7.4): 22.26; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 37.53 Å2; (13)Index of Refraction: 1.64; (14)Molar Refractivity: 42.174 cm3; (15)Molar Volume: 116.966 cm3; (16)Polarizability: 16.719×10-24cm3; (17)Surface Tension: 51.40 dyne/cm; (18)Density: 1.267 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: OCc1cnc2ccccn12
(2)Std. InChI: InChI=1S/C8H8N2O/c11-6-7-5-9-8-3-1-2-4-10(7)8/h1-5,11H,6H2
(3)Std. InChIKey: SWAGAGZXOOYJDS-UHFFFAOYSA-N