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CAS No.: | 82090-52-6 |
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Name: | IMIDAZO[1,2-A]PYRIDIN-2-YLMETHANOL |
Article Data: | 12 |
Molecular Structure: | |
Formula: | C8H8N2O |
Molecular Weight: | 148.164 |
Synonyms: | 2-(Hydroxymethyl)imidazo[1,2-a]pyridine;Imidazo[1,2-a]pyridin-2-ylmethanol; |
Density: | 1.267 g/cm3 |
Melting Point: | 101.5-103.5 °C |
Hazard Symbols: | Xi |
Risk Codes: | 36/37/38 |
Safety: | 22-26-36/37/39 |
PSA: | 37.53000 |
LogP: | 0.82660 |
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The Imidazo[1,2-a]pyridine-2-methanol, with the CAS registry number 6840-45-5, is also known as 2-(Hydroxymethyl)imidazo[1,2-a]pyridine. It belongs to the product categories of Hydroxymethyl's and Fused Ring Systems. This chemical's molecular formula is C8H8N2O and molecular weight is 148.16. What's more, both its IUPAC name and systematic name are the same which is called Imidazo[1,2-a]pyridine-2-methanol.
Physical properties about Imidazo[1,2-a]pyridine-2-methanol are: (1) ACD/LogP: 0.30; (2) # of Rule of 5 Violations: 0; (3) ACD/KOC (pH 7.4): 27.016; (4) ACD/LogD (pH 7.4): 0.19; (5) ACD/BCF (pH 5.5): 1; (6) ACD/BCF (pH 7.4): 1; (7) ACD/KOC (pH 5.5): 1.597; (8) Surface Tension: 51.396 dyne/cm; (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: 1.641; (14) Molar Refractivity: 42.174 cm3; (15) Molar Volume: 116.966 cm3; (16) Density: 1.267 g/cm3; (17) Melting Point: 101.5-103.5 °C.
When you are dealing with this chemical, you should be very careful. This chemical is irritant and may cause inflammation to the skin or other mucous membranes.
You can still convert the following datas into molecular structure:
(1) SMILES: c1ccn2cc(nc2c1)CO
(2) InChI: InChI=1/C8H8N2O/c11-6-7-5-10-4-2-1-3-8(10)9-7/h1-5,11H,6H2
(3) InChIKey: ROPHYEIJSUUKEO-UHFFFAOYAN