P-BENZANISIDIDE

The Benzamide,N-(4-methoxyphenyl)- is an organic compound with the formula C₁₄H₁₃NO₂. The IUPAC name of this chemical is N-(4-methoxyphenyl)benzamide. With the CAS registry number 7472-54-0, it is also named as 4'-Methoxybenzanilide. Besides, it should be stored in a closed cool and dry place.

Physical properties about Benzamide,N-(4-methoxyphenyl)- are: (1)ACD/LogP: 2.62; (2)ACD/LogD (pH 5.5): 2.624; (3)ACD/LogD (pH 7.4): 2.624; (4)ACD/BCF (pH 5.5): 58.092; (5)ACD/BCF (pH 7.4): 58.095; (6)ACD/KOC (pH 5.5): 637.325; (7)ACD/KOC (pH 7.4): 637.356; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 3; (11)Polar Surface Area: 38.33 Å²; (12)Index of Refraction: 1.619; (13)Molar Refractivity: 67.507 cm³; (14)Molar Volume: 192.307 cm³; (15)Polarizability: 26.762×10^-24cm³; (16)Surface Tension: 47.016 dyne/cm; (17)Density: 1.182 g/cm³; (18)Flash Point: 129.288 °C; (19)Enthalpy of Vaporization: 52.952 kJ/mol; (20)Boiling Point: 290.166 °C at 760 mmHg; (21)Vapour Pressure: 0.002 mmHg at 25°C.

Preparation: this chemical can be prepared by 4-methoxy-aniline and benzoic acid. This reaction will need reagent Ti(BuO)₄ and solvent o-xylene. The reaction time is 2.5 hours with reaction temperature of 145 °C. The yield is about 98%.

Uses of Benzamide,N-(4-methoxyphenyl)-: it can be used to produce N-(4-methoxy-phenyl)-thiobenzamide by heating. It will need reagent P₂S₅ and solvent apyridine with reaction time of 3 hours. The yield is about 41%.

You can still convert the following datas into molecular structure:
(1)SMILES: COc1ccc(cc1)NC(=O)c2ccccc2
(2)InChI: InChI=1/C14H13NO2/c1-17-13-9-7-12(8-10-13)15-14(16)11-5-3-2-4-6-11/h2-10H,1H3,(H,15,16)
(3)InChIKey: KEEBHMMBUBEEOV-UHFFFAOYAI
(4)Std. InChI: InChI=1S/C14H13NO2/c1-17-13-9-7-12(8-10-13)15-14(16)11-5-3-2-4-6-11/h2-10H,1H3,(H,15,16)
(5)Std. InChIKey: KEEBHMMBUBEEOV-UHFFFAOYSA-N