N,N'-DIBENZYLPHTHALAMIDE

The 1,2-Benzenedicarboxamide,N1,N2-bis(phenylmethyl)-, with CAS registry number 38228-99-8, has the systematic name of N,N'-dibenzylbenzene-1,2-dicarboxamide. And the chemical formula of this chemical is C₂₂H₂₀N₂O₂. Its molecular weight is 344.4064.

Physical properties of 1,2-Benzenedicarboxamide,N1,N2-bis(phenylmethyl)-: (1)ACD/LogP: 3.13; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.12; (4)ACD/LogD (pH 7.4): 3.12; (5)ACD/BCF (pH 5.5): 139.58; (6)ACD/BCF (pH 7.4): 139.58; (7)ACD/KOC (pH 5.5): 1193.67; (8)ACD/KOC (pH 7.4): 1193.67; (9)#H bond acceptors: 4; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 6; (12)Polar Surface Area: 40.62 Å²; (13)Index of Refraction: 1.62; (14)Molar Refractivity: 102.47 cm³; (15)Molar Volume: 291.5 cm³; (16)Polarizability: 40.62×10^-24cm³; (17)Surface Tension: 50.6 dyne/cm; (18)Density: 1.181 g/cm ³; (19)Flash Point: 224.3 °C; (20)Enthalpy of Vaporization: 93.72 kJ/mol; (21)Boiling Point: 634 °C at 760 mmHg; (22)Vapour Pressure: 5.56E-16 mmHg at 25°C.

Preparation: this chemical can be prepared by phthalic acid and benzylamine. This reaction will need solvent xylene. The reaction time is 7.5 hour(s). The yield is about 98%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(NCc1ccccc1)c3ccccc3C(=O)NCc2ccccc2
(2)InChI: InChI=1/C22H20N2O2/c25-21(23-15-17-9-3-1-4-10-17)19-13-7-8-14-20(19)22(26)24-16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H,23,25)(H,24,26)
(3)InChIKey: STGVIVVZSAQRGJ-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C22H20N2O2/c25-21(23-15-17-9-3-1-4-10-17)19-13-7-8-14-20(19)22(26)24-16-18-11-5-2-6-12-18/h1-14H,15-16H2,(H,23,25)(H,24,26)
(5)Std. InChIKey: STGVIVVZSAQRGJ-UHFFFAOYSA-N