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873913-87-2

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Basic Information
CAS No.: 873913-87-2
Name: 6-Chloro-2,3-diphenylimidazo[1,2-b]pyridazine
Article Data: 3
Molecular Structure:
Molecular Structure of 873913-87-2 (6-Chloro-2,3-diphenylimidazo[1,2-b]pyridazine)
Formula: C18H12ClN3
Molecular Weight: 305.766
Synonyms: 6-Chloro-2,3-diphenylimidazo[1,2-b]pyridazine;
Density: 1.286 g/cm3
PSA: 30.19000
LogP: 4.71670
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Specification

The 6-Chloro-2,3-diphenylimidazo[1,2-b]pyridazine with the CAS number 873913-87-2 is also called Imidazo[1,2-b]pyridazine,6-chloro-2,3-diphenyl-. Its molecular formula is C18H12ClN3. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 6-Chloro-2,3-diphenylimidazo[1,2-b]pyridazine are: (1)ACD/LogP: 4.57; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 4; (4)ACD/LogD (pH 7.4): 4; (5)ACD/BCF (pH 5.5): 599; (6)ACD/BCF (pH 7.4): 600; (7)ACD/KOC (pH 5.5): 3383; (8)ACD/KOC (pH 7.4): 3391; (9)#H bond acceptors: 3; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 30.19 Å2; (13)Index of Refraction: 1.681; (14)Molar Refractivity: 89.97 cm3; (15)Molar Volume: 237.827 cm3; (16)Polarizability: 35.667×10-24cm3; (17)Surface Tension: 50.07 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nn2c(c(nc2cc1)c3ccccc3)c4ccccc4
(2)InChI: InChI=1/C18H12ClN3/c19-15-11-12-16-20-17(13-7-3-1-4-8-13)18(22(16)21-15)14-9-5-2-6-10-14/h1-12H
(3)InChIKey: WOPARXSWYJDAQV-UHFFFAOYAV