methoxyazanium chloride

• ChemBase ID: 302084
• Molecular Formular: CH6ClNO
• Molecular Mass: 83.51744
• Monoisotopic Mass: 83.0137915
• SMILES: CO[NH3+].[Cl-]
• Canonical SMILES: CO[NH3+].[Cl-]
• InChI: InChI=1S/CH6NO.ClH/c1-3-2;/h1-2H3;1H/q+1;/p-1
• InChIKey: SPUACDWLOLSOQO-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: methoxyazanium chloride
• IUPAC Traditional name: methoxyazanium chloride
• Synonyms: Methoxyamine hydrochloride; O-Methylhydroxylamine hydrochloride; Methoxylamine hydrochloride; 甲氧胺盐酸盐

Database IDs

• CAS Number: 593-56-6
• EC Number: 209-798-7
• MDL Number: MFCD00012951
• Beilstein Number: 3589723
• Merck Index: 145989

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.39036477
• LogD (pH = 7.4): -0.36289734
• Log P: -0.36253566
• Molar Refractivity: 22.5618 cm^3
• Polarizability: 4.7594404 Å^3
• Polar Surface Area: 36.87 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Density: 1.100

Safety Information

• RTECS: NC3980000
• European Hazard Symbols: Corrosive (C); Nature polluting (N); X
• UN Number: UN3265
• Hazard Class: 8
• Packing Group: II
• Risk Statements: 22-34-43-50
• Safety Statements: 26-36/37/39-45-61
• TSCA Listed: 是
• GHS Pictograms: GHS05; GHS06; GHS09
• GHS Hazard statements: H301-H317-H314-H318-H400
• GHS Precautionary statements: P260-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A

Product Information

• Purity: 25-30% aq. soln.