hydroxyazanium chloride

• ChemBase ID: 127754
• Molecular Formular: ClH4NO
• Molecular Mass: 69.49086
• Monoisotopic Mass: 68.99814143
• SMILES: [Cl-].O[NH3+]
• Canonical SMILES: O[NH3+].[Cl-]
• InChI: InChI=1S/ClH.H4NO/c;1-2/h1H;2H,1H3/q;+1/p-1
• InChIKey: WCYJQVALWQMJGE-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: hydroxyazanium chloride
• IUPAC Traditional name: hydroxyazanium chloride
• Synonyms: Hydroxylamine hydrochloride; Hydroxylammonium chloride

Database IDs

• CAS Number: 5470-11-1
• EC Number: 226-798-2
• PubChem SID: 162222072
• PubChem CID: 21645
• CHEMBL: 542448
• Chemspider ID: 20344
• Wikipedia Title: Hydroxylammonium_chloride

CALCULATED PROPERTIES

• Acid pKa: 17.64608
• H Acceptors: 1
• H Donor: 2
• LogD (pH = 5.5): -0.7521895
• LogD (pH = 7.4): -0.7406456
• Log P: -0.7404964
• Molar Refractivity: 18.0795 cm^3
• Polarizability: 2.8914602 Å^3
• Polar Surface Area: 47.87 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: white crystalline solid
• Melting Point: 155 - 157 °C (311 - 315 °F) - decomp
• Density: 1.67 g/cm^3

Safety Information

• RTECS: NC3675000
• European Hazard Symbols: Carc3; Explosive (E); Nature polluting (N); Irritant (Xi); Harmful (Xn)
• Risk Statements: R2, R21/22, R36/38, R40, R43, R48/22, R50
• Safety Statements: S2, S36/37, S61
• EU Index: 612-123-00-2
• NFPA704:
  

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