1,3,4-Oxadiazol-2-amine,5-(2-chlorophenyl)- (2138-98-9)

The cas register number of 2-Amino-5-(2-chlorophenyl)-1,3,4-oxadiazole is 2138-98-9. It also can be called as 5-(2-Chlorophenyl)-1,3,4-oxadiazol-2-amine and the Systematic name about this chemical is 5-(4-chlorophenyl)-1,3,4-oxadiazol-2-amine. It belongs to the following product categories, such as Amines, Oxadiazoles & Thiadiazoles, Oxadiazoles & Thiadiazoles and so on.

Physical properties about 2-Amino-5-(2-chlorophenyl)-1,3,4-oxadiazole are: (1)ACD/LogP: 2.21; (2)ACD/LogD (pH 5.5): 2.21; (3)ACD/LogD (pH 7.4): 2.21; (4)ACD/BCF (pH 5.5): 28.13; (5)ACD/BCF (pH 7.4): 28.13; (6)ACD/KOC (pH 5.5): 379.27; (7)ACD/KOC (pH 7.4): 379.27; (8)#H bond acceptors: 4; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 42.16Ų; (12)Index of Refraction: 1.618; (13)Molar Refractivity: 48.45 cm³; (14)Molar Volume: 138.1 cm³; (15)Polarizability: 19.21x10^-24cm³; (16)Surface Tension: 60 dyne/cm; (17)Enthalpy of Vaporization: 60.37 kJ/mol; (18)Boiling Point: 358.3 °C at 760 mmHg; (19)Vapour Pressure: 2.58E-05 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc2ccc(c1nnc(o1)N)cc2
(2)InChI: InChI=1/C8H6ClN3O/c9-6-3-1-5(2-4-6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)
(3)InChIKey: ZMWWZXSPDQIWAZ-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C8H6ClN3O/c9-6-3-1-5(2-4-6)7-11-12-8(10)13-7/h1-4H,(H2,10,12)
(5)Std. InChIKey: ZMWWZXSPDQIWAZ-UHFFFAOYSA-N