The CAS registry number of N-Benzylhydroxylamine hydrochloride is 29601-98-7. The IUPAC name is N-hydroxy-1-phenylmethanamine hydrochloride. In addition, the formula is C7H10ClNO and the molecular weight is 159.6134. It belongs to the classes of Hydroxylamines; Nitrogen Compounds; Organic Building Blocks.
Physical properties about this chemical are: (1)ACD/LogP: 1.30; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.22; (4)ACD/LogD (pH 7.4): 1.3; (5)ACD/BCF (pH 5.5): 4.76; (6)ACD/BCF (pH 7.4): 5.73; (7)ACD/KOC (pH 5.5): 100.69; (8)ACD/KOC (pH 7.4): 121.38; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 9.23 Å2 ; (13)Flash Point: 135.2 °C; (14)Enthalpy of Vaporization: 51.91 kJ/mol; (15)Boiling Point: 253.9 °C at 760 mmHg; (16)Vapour Pressure: 0.00923 mmHg at 25°C.
Uses of N-benzylhydroxylamine hydrochloride: it can react with hydroxyacetic acid to get N-Benzyl-2-hydroxyacetohydroxamsaeure. This reaction will need reagents Et3N and DCC and solvents propan-2-ol and CHCl3. The reaction time is 48 hours at ambient temperature. The yield is about 55%.
When you are using this chemical, please be cautious about it as the following:
It is irritating to eyes, respiratory system and skin. When you are using it, wear suitable gloves and eye/face protection. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1)SMILES: Cl.ONCc1ccccc1
(2)InChI: InChI=1/C7H9NO.ClH/c9-8-6-7-4-2-1-3-5-7;/h1-5,8-9H,6H2;1H
(3)InChIKey: YSNXOQGDHGUKCZ-UHFFFAOYAO
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