N-BENZYL 2-BROMOBENZAMIDE

The Benzamide,2-bromo-N-(phenylmethyl)-, with the CAS registry number 82082-50-6, is also known as (2-Bromophenyl)-N-benzylcarboxamide. It belongs to the product categories of Blocks; Bromides; Carboxes. This chemical's molecular formula is C₁₄H₁₂BrNO and molecular weight is 290.16. What's more, its systematic name is called N-Benzyl-2-bromobenzamide. When you are dealing with this chemical, you should be very careful. This chemical may cause inflammation to the skin or other mucous membranes.

Physical properties about Benzamide,2-bromo-N-(phenylmethyl)- are: (1) ACD/LogP: 3.30; (2) # of Rule of 5 Violations: 0; (3) ACD/LogD (pH 5.5): 3.3; (4) ACD/LogD (pH 7.4): 3.3; (5) ACD/BCF (pH 5.5): 188.43; (6) ACD/BCF (pH 7.4): 188.43; (7) ACD/KOC (pH 5.5): 1479.65; (8) ACD/KOC (pH 7.4): 1479.65; (9) #H bond acceptors: 2; (10) #H bond donors: 1; (11) #Freely Rotating Bonds: 3; (12) Polar Surface Area: 20.31 Å²; (13) Index of Refraction: 1.614; (14) Molar Refractivity: 72.05 cm³; (15) Molar Volume: 206.6 cm³; (16) Surface Tension: 47.6 dyne/cm; (17) Density: 1.404 g/cm³; (18)Flash Point: 218.7 °C; (19) Enthalpy of Vaporization: 69.48 kJ/mol; (20) Boiling Point: 438 °C at 760 mmHg; (21) Vapour Pressure: 7.13E-08 mmHg at 25 °C ; (22) Melting Point: 110-114°C.

Preparation of Benzamide,2-bromo-N-(phenylmethyl)-: this chemical can be prepared by 2-Bromo-benzoyl chloride with Benzylamine.

This reaction needs reagent Triethylamine and solvent Benzene. The reaction time is 18 hours.

You can still convert the following datas into molecular structure:
(1) SMILES: O=C(c1ccccc1Br)NCc2ccccc2
(2) InChI: InChI=1/C14H12BrNO/c15-13-9-5-4-8-12(13)14(17)16-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)
(3) InChIKey: PUIYIJWJYXUFGR-UHFFFAOYAL