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CAS No.: | 887625-09-4 |
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Name: | 2-Amino-6-chloroimidazo[1,2-b]pyridazine |
Article Data: | 7 |
Molecular Structure: | |
Formula: | C6H5ClN4 |
Molecular Weight: | 168.585 |
Synonyms: | 6-chloroimidazo[1,2-b]pyridazin-2-amine;Imidazo[1,2-b]pyridazin-2-amine, 6-chloro-; |
Density: | 1.715 g/cm3 |
PSA: | 56.21000 |
LogP: | 1.54610 |
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The CAS register number of 2-Amino-6-chloroimidazo[1,2-b]pyridazine is 887625-09-4. It also can be called as Imidazo[1,2-b]pyridazin-2-amine, 6-chloro- and the systematic name about this chemical is 6-chloroimidazo[1,2-b]pyridazin-2-amine. The molecular formula about this chemical is C6H5ClN4 and the molecular weight is 168.5837.
Physical properties about 2-Amino-6-chloroimidazo[1,2-b]pyridazine are: (1)ACD/LogP: 1.09; (2)ACD/LogD (pH 7.4): 0.934; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 2.773; (5)ACD/KOC (pH 5.5): 2.94; (6)ACD/KOC (pH 7.4): 65.275; (7)#H bond acceptors: 4; (8)#H bond donors: 2; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 56.21Å2; (11)Index of Refraction: 1.791; (12)Molar Refractivity: 41.674 cm3; (13)Molar Volume: 98.307 cm3; (14)Polarizability: 16.521x10-24cm3; (15)Surface Tension: 71.701 dyne/cm.
You can still convert the following datas into molecular structure:
(1)SMILES: c1cc(nn2c1nc(c2)N)Cl
(2)InChI: InChI=1/C6H5ClN4/c7-4-1-2-6-9-5(8)3-11(6)10-4/h1-3H,8H2
(3)InChIKey: VEHNVCGISXDBIG-UHFFFAOYAW
(4)Std. InChI: InChI=1S/C6H5ClN4/c7-4-1-2-6-9-5(8)3-11(6)10-4/h1-3H,8H2
(5)Std. InChIKey: VEHNVCGISXDBIG-UHFFFAOYSA-N