Benzamide,N-hydroxy-N-phenyl- (304-88-1)

The N-Phenylbenzohydroxamic acid, with CAS registry number 304-88-1, belongs to the following product categories: (1)Analytical Chemistry; (2)Bipyridyls, etc. (Chelating Reagents); (3)Chelating Reagents; (4)Hydroxylamines; (5)Hydroxylamines (N-Substituted). Its systematic name and its IUPAC name are the same, which is N-hydroxy-N-phenylbenzamide. This chemical is a kind of off-white fibrous powder. It should be stored at the temperature of 2-8°C. When use this chemical, please do not breathe dust and avoid contact with skin and eyes.

Physical properties of N-Phenylbenzohydroxamic acid: (1)ACD/LogP: 2.61; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.61; (4)ACD/LogD (pH 7.4): 2.53; (5)ACD/BCF (pH 5.5): 56.44; (6)ACD/BCF (pH 7.4): 47.03; (7)ACD/KOC (pH 5.5): 623.84; (8)ACD/KOC (pH 7.4): 519.89; (9)#H bond acceptors: 3; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 29.54 Å²; (13)Index of Refraction: 1.666; (14)Molar Refractivity: 62.43 cm³; (15)Molar Volume: 167.8 cm³; (16)Polarizability: 24.75×10^-24cm³; (17)Surface Tension: 59.9 dyne/cm; (18)Enthalpy of Vaporization: 64.99 kJ/mol; (19)Vapour Pressure: 4.19E-06 mmHg at 25°C.

Preparation: this chemical can be prepared by N-methoxy-benzanilide. This reaction will need reagents AlCl₃, Me₂S. The reaction time is 0.25 hour(s). The yield is about 91%.

Uses of N-Phenylbenzohydroxamic acid: it can be used to produce 1-benzoyl-piperidine. This reaction will need reagent 0.1 M NaClO₄ and solvent acetonitrile . The yield is about 71%.

You can still convert the following datas into molecular structure:
(1)SMILES: O=C(N(O)c1ccccc1)c2ccccc2
(2)InChI: InChI=1/C13H11NO2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,16H
(3)InChIKey: YLYIXDZITBMCIW-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C13H11NO2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,16H
(5)Std. InChIKey: YLYIXDZITBMCIW-UHFFFAOYSA-N