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CAS No.: | 14793-00-1 |
---|---|
Name: | IMIDAZO[1,2-B]PYRIDAZINE, 6-CHLORO-2-METHYL- |
Article Data: | 13 |
Molecular Structure: | |
Formula: | C7H6ClN3 |
Molecular Weight: | 167.598 |
Synonyms: | 6-Chloro-2-methylimidazo[1,2-b]pyridazine; |
Density: | 1.436 g/cm3 |
PSA: | 30.19000 |
LogP: | 1.69110 |
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The Imidazo[1,2-b]pyridazine,6-chloro-2-methyl-, with the CAS registry number 14793-00-1, is also known as 3-Chloro-8-methyl-1,2,7-triazabicyclo[4.3.0]nona-2,4,6,8-tetraene. This chemical's molecular formula is C7H6ClN3 and molecular weight is 167.6. Its IUPAC name is called 6-chloro-2-methylimidazo[1,2-b]pyridazine.
Physical properties of Imidazo[1,2-b]pyridazine,6-chloro-2-methyl-: (1)ACD/LogP: 1.51; (2)ACD/LogD (pH 5.5): 1.446; (3)ACD/LogD (pH 7.4): 1.509; (4)ACD/BCF (pH 5.5): 7.142; (5)ACD/BCF (pH 7.4): 8.249; (6)ACD/KOC (pH 5.5): 136.376; (7)ACD/KOC (pH 7.4): 157.52; (8)#H bond acceptors: 3; (9)Index of Refraction: 1.681; (10)Molar Refractivity: 44.183 cm3; (11)Molar Volume: 116.746 cm3; (12)Surface Tension: 49.711 dyne/cm; (13)Density: 1.436 g/cm3.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CN2C(=N1)C=CC(=N2)Cl
(2)InChI: InChI=1S/C7H6ClN3/c1-5-4-11-7(9-5)3-2-6(8)10-11/h2-4H,1H3
(3)InChIKey: GWHLOBFYCUGPGE-UHFFFAOYSA-N