hydrogen O-methylhydroxylamine chloride

• ChemBase ID: 286779
• Molecular Formular: CH5ClNO-
• Molecular Mass: 82.5095
• Monoisotopic Mass: 82.00596647
• SMILES: [Cl-].CON
• Canonical SMILES: CON.[Cl-]
• InChI: InChI=1S/CH5NO.ClH/c1-3-2;/h2H2,1H3;1H/p-1
• InChIKey: XNXVOSBNFZWHBV-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: hydrogen O-methylhydroxylamine chloride
• IUPAC Traditional name: hydrogen O-methylhydroxylamine chloride
• Synonyms: O-Methylhydroxylamine hydrochloride

Database IDs

• CAS Number: 593-56-6
• MDL Number: MFCD00012951
• PubChem SID: 180672310
• PubChem CID: 22728883

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 1
• LogD (pH = 5.5): -0.39036477
• LogD (pH = 7.4): -0.36289734
• Log P: -0.36253566
• Molar Refractivity: 12.331 cm^3
• Polarizability: 4.8056803 Å^3
• Polar Surface Area: 35.25 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Product Information

• Purity: 98%