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CAS No.: | 2491-99-8 |
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Name: | 2,5-bis(3,4-dichlorophenyl)-1,3,4-oxadiazole |
Molecular Structure: | |
Formula: | C14H6Cl4N2O |
Molecular Weight: | 360.026 |
Synonyms: | NSC 90456; |
Density: | 1.518 g/cm3 |
Boiling Point: | 492.3 °C at 760 mmHg |
Flash Point: | 251.6 °C |
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The 1,3,4-Oxadiazole,2,5-bis(3,4-dichlorophenyl)-, with the CAS registry number 2491-99-8, has the molecular formula C14H6Cl4N2O. Besides, its molecular weight is 360.0222. Its systematic name is called 2,5-bis(3,4-dichlorophenyl)-1,3,4-oxadiazole.
Physical properties of 1,3,4-Oxadiazole,2,5-bis(3,4-dichlorophenyl)-: (1)ACD/LogP: 7.02; (2)#H bond acceptors: 3; (3)#Freely Rotating Bonds: 2; (4)Index of Refraction: 1.622; (5)Molar Refractivity: 83.49 cm3; (6)Molar Volume: 237 cm3; (7)Surface Tension: 53 dyne/cm; (8)Density: 1.518 g/cm3; (9)Flash Point: 251.6 °C; (10)Enthalpy of Vaporization: 73.04 kJ/mol; (11)Boiling Point: 492.3 °C at 760 mmHg; (12)Vapour Pressure: 2.34E-09 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Clc3ccc(c1nnc(o1)c2cc(Cl)c(Cl)cc2)cc3Cl
(2)InChI: InChI=1/C14H6Cl4N2O/c15-9-3-1-7(5-11(9)17)13-19-20-14(21-13)8-2-4-10(16)12(18)6-8/h1-6H
(3)InChIKey: YMEGRHRBQLZTKN-UHFFFAOYAL