5-Benzyl-3-(2-bromophenyl)-1,2,4-oxadiazole supplier

Name
3-(2-Bromophenyl)-5-phenyl-1,2,4-oxadiazole
EINECS
CAS No. 827332-78-5
Article Data3
CAS DataBase
Density 1.465 g/cm³
Solubility
Melting Point
Formula C₁₄H₉BrN₂O
Boiling Point 428.8 °C at 760 mmHg
Molecular Weight 301.142
Flash Point 213.1 °C
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms 3-(2-Bromophenyl)-5-phenyl-1,2,4-oxadiazole;
PSA 38.92000
LogP 4.16610

5-Benzyl-3-(2-bromophenyl)-1,2,4-oxadiazole Specification

The CAS registry number of 827332-78-5 is called 5-Benzyl-3-(2-bromophenyl)-1,2,4-oxadiazole. The IUPAC name is 3-(2-bromophenyl)-5-phenyl-1,2,4-oxadiazole. In addition, the formula is C₁₄H₉BrN₂O and the molecular weight is 301.1381.

Physical properties about this chemical are: (1)ACD/LogP: 4.50; (2)# of Rule of 5 Violations: 0 ; (3)#H bond acceptors: 3; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 38.92 Å²; (7)Index of Refraction: 1.614; (8)Molar Refractivity: 71.6 cm³; (9)Molar Volume: 205.4 cm³; (10)Polarizability: 28.38 ×10^-24cm³; (11)Surface Tension: 50.1 dyne/cm; (12)Density: 1.465 g/cm³; (13)Flash Point: 213.1 °C; (14)Enthalpy of Vaporization: 65.76 kJ/mol ; (15)Boiling Point: 428.8 °C at 760 mmHg; (16)Vapour Pressure: 3.68E-07 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccccc1c2nc(on2)c3ccccc3
(2)InChI: InChI=1/C14H9BrN2O/c15-12-9-5-4-8-11(12)13-16-14(18-17-13)10-6-2-1-3-7-10/h1-9H
(3)InChIKey: YNEFEUXUIWJXNR-UHFFFAOYAM

Product Name

3-(2-Bromophenyl)-5-phenyl-1,2,4-oxadiazole

5-Benzyl-3-(2-bromophenyl)-1,2,4-oxadiazole Specification

Related Products

Hot Products