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CAS No.: | 475992-33-7 |
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Name: | 7-Chloro-2-(3,4-dimethylphenyl)H-imidazo[1,2-a]pyridine |
Molecular Structure: | |
Formula: | C15H13ClN2 |
Molecular Weight: | 256.7301 |
Synonyms: | 7-chloro-2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine; |
Density: | 1.213 g/cm3 |
PSA: | 17.30000 |
LogP: | 4.27150 |
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The CAS registry number of 7-Chloro-2-(3,4-dimethylphenyl)H-imidazo[1,2-a]pyridine is 475992-33-7. This chemical's molecular formula is C15H13ClN2 and molecular weight is 256.7301. What's more, its system name is 7-Chloro-2-(3,4-dimethylphenyl)imidazo[1,2-a]pyridine.
Physical properties about 7-Chloro-2-(3,4-dimethylphenyl)H-imidazo[1,2-a]pyridine: (1)ACD/LogP:5.00; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 5; (4)ACD/LogD (pH 7.4): 5; (5)ACD/BCF (pH 5.5): 3113; (6)ACD/BCF (pH 7.4): 4188; (7)ACD/KOC (pH 5.5): 10113; (8)ACD/KOC (pH 7.4): 13605; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 17.3 Å2; (13)Index of Refraction: 1.63; (14)Molar Refractivity: 75.266 cm3; (15)Molar Volume: 211.628 cm3; (16)Surface Tension: 41.398 dyne/cm; (17)Density: 1.213 g/cm3.
You can still convert the following datas into molecular structure:
(1) SMILES: Clc1ccn2cc(nc2c1)c3ccc(c(c3)C)C
(2) InChI: InChI=1/C15H13ClN2/c1-10-3-4-12(7-11(10)2)14-9-18-6-5-13(16)8-15(18)17-14/h3-9H,1-2H3
(3) InChIKey: NNZGPFIWRHKROM-UHFFFAOYAN