The 2-Amino-pyridine-3-carbaldehyde oxime HCl, with the CAS registry number 653584-65-7, is also known as 2-Amino-pyridine-3-carbaldehyde oxime hydrochloride. It belongs to the product categories of Pharmacetical; Pyridine. This chemical's molecular formula is C6H8ClN3O and molecular weight is 173.6. What's more, its IUPAC name is (NE)-N-[(2-Aminopyridin-3-yl)methylidene]hydroxylamine hydrochloride. In addition, this chemical may cause inflammation to the skin or other mucous membranes.
Physical properties about 2-Amino-pyridine-3-carbaldehyde oxime HCl are: (1)ACD/LogP: 1.52; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.12; (4)ACD/LogD (pH 7.4): 1.51; (5)ACD/BCF (pH 5.5): 3.39; (6)ACD/BCF (pH 7.4): 8.24; (7)ACD/KOC (pH 5.5): 64.43; (8)ACD/KOC (pH 7.4): 156.63; (9)#H bond acceptors: 4; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 2; (12)Polar Surface Area: 71.5 Å2; (13)Flash Point: 151.9 °C; (14)Enthalpy of Vaporization: 60.15 kJ/mol; (15)Boiling Point: 327.5 °C at 760 mmHg; (16)Vapour Pressure: 8.14E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: Cl.Nc1ncccc1\C=N\O
(2) InChI: InChI=1/C6H7N3O.ClH/c7-6-5(4-9-10)2-1-3-8-6;/h1-4,10H,(H2,7,8);1H/b9-4+;
(3) InChIKey: DGNBEVBYMQDDDO-JOKMOOFLBH
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