3-Chlorophenylhydroxylamine (10468-17-4)

The 3-Chlorophenylhydroxylamine, its cas register number is 10468-17-4. It also can be called as 3-Chloro-N-hydroxyaniline and the Systematic name about this chemical is 3-chloro-N-hydroxyaniline.

Physical properties about 3-Chlorophenylhydroxylamine are: (1)ACD/LogP: 1.00; (2)ACD/LogD (pH 5.5): 2; (3)ACD/LogD (pH 7.4): 2; (4)ACD/BCF (pH 5.5): 14; (5)ACD/BCF (pH 7.4): 13; (6)ACD/KOC (pH 5.5): 232; (7)ACD/KOC (pH 7.4): 214; (8)#H bond acceptors: 2; (9)#H bond donors: 2; (10)#Freely Rotating Bonds: 2; (11)Polar Surface Area: 32.26Ų; (12)Index of Refraction: 1.661; (13)Molar Refractivity: 37.659 cm³; (14)Molar Volume: 101.84 cm³; (15)Polarizability: 14.929x10^-24cm³; (16)Surface Tension: 56.315 dyne/cm; (17)Enthalpy of Vaporization: 51.403 kJ/mol; (18)Vapour Pressure: 0.012 mmHg at 25°C

Preparation: this chemical can be prepared by 1-chloro-3-nitro-benzene at Ambient temperature. This reaction will need reagent KBH₄, BiCl₃ and aq. ethanol. The reaction time is 15 min. The yield is about 83 %.

Uses of 3-Chlorophenylhydroxylamine: it can be used to produce bis-(3-chloro-phenyl)-diazene-N-oxide at Ambient temperature. It will need reagent NaOH, O₂ with reaction time of 4 hours. The yield is about 90%.

You can still convert the following datas into molecular structure:
(1)SMILES: ONc1cc(Cl)ccc1
(2)InChI: InChI=1/C6H6ClNO/c7-5-2-1-3-6(4-5)8-9/h1-4,8-9H
(3)InChIKey: CTTWLAMAVFBFAR-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C6H6ClNO/c7-5-2-1-3-6(4-5)8-9/h1-4,8-9H
(5)Std. InChIKey: CTTWLAMAVFBFAR-UHFFFAOYSA-N