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| CAS No.: | 4044-99-9 |
|---|---|
| Name: | 6-BROMO-2-METHYLIMIDAZO[1,2-A]PYRIDINE |
| Article Data: | 9 |
| Molecular Structure: | |
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| Formula: | C8H7BrN2 |
| Molecular Weight: | 211.06 |
| Synonyms: | 6-BROMO-2-METHYLIMIDAZO[1,2-A]PYRIDINE;IMidazo[1,2-a]pyridine, 6-broMo-2-Methyl- |
| Density: | 1.6 g/cm3 |
| Melting Point: | 101.0-101.5 °C |
| PSA: | 17.30000 |
| LogP: | 2.40520 |
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Specification
The Imidazo[1,2-a]pyridine, 6-bromo-2-methyl- is an organic compound with the formula C8H7BrN2. The systematic name of this chemical is 6-bromo-2-methylimidazo[1,2-a]pyridine. With the CAS registry number 4044-99-9, it is also named as 6-bromo-2-methyl-4-hydroimidazo[1,2-a]pyridine. The product's categories are Fused Ring Systems; Halides.
Physical properties about Imidazo[1,2-a]pyridine, 6-bromo-2-methyl- are: (1)ACD/LogP: 2.56; (2)ACD/LogD (pH 5.5): 2.21; (3)ACD/LogD (pH 7.4): 2.55; (4)ACD/BCF (pH 5.5): 23.08; (5)ACD/BCF (pH 7.4): 50.82; (6)ACD/KOC (pH 5.5): 261.84; (7)ACD/KOC (pH 7.4): 576.58; (8)#H bond acceptors: 2; (9)Polar Surface Area: 17.3 Å2; (10)Index of Refraction: 1.663; (11)Molar Refractivity: 48.69 cm3; (12)Molar Volume: 131.3 cm3; (13)Polarizability: 19.3×10-24cm3; (14)Surface Tension: 46.7 dyne/cm; (15)Density: 1.6 g/cm3.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1cn2cc(C)nc2cc1
(2)InChI: InChI=1/C8H7BrN2/c1-6-4-11-5-7(9)2-3-8(11)10-6/h2-5H,1H3
(3)InChIKey: TVHRDJPRECFZQO-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C8H7BrN2/c1-6-4-11-5-7(9)2-3-8(11)10-6/h2-5H,1H3
(5)Std. InChIKey: TVHRDJPRECFZQO-UHFFFAOYSA-N