(2H); (2H4)azanium

• ChemBase ID: 303113
• Molecular Formular: NO
• Molecular Mass: 30.0061
• Monoisotopic Mass: 29.99798863
• SMILES: [NH4+].[OH-]
• Canonical SMILES: [NH4+].[OH-]
• InChI: InChI=1S/H3N.H2O/h1H3;1H2
• InChIKey: VHUUQVKOLVNVRT-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (^2H); (^2H₄)azanium
• IUPAC Traditional name: (^2H₄)azanium; water-d1
• Synonyms: Ammonium hydroxide, deuterated; Ammonium-d; deuteroxide

Database IDs

• CAS Number: 12168-30-8
• EC Number: 235-332-7
• MDL Number: MFCD00064511

CALCULATED PROPERTIES

• H Acceptors: 0
• H Donor: 1
• LogD (pH = 5.5): -3.7525723
• LogD (pH = 7.4): -2.4393091
• Log P: -0.978
• Molar Refractivity: 16.3149 cm^3
• Polarizability: 2.1934314 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid
• Refractive Index: 1.3340

Safety Information

• Storage Warning: Moisture Sensitive
• European Hazard Symbols: Corrosive (C); Nature polluting (N)
• UN Number: UN2672
• Hazard Class: 8
• Packing Group: III
• Risk Statements: 34-50
• Safety Statements: 26-36/37/39-45-57-60
• TSCA Listed: 否
• GHS Pictograms: GHS05; GHS09
• GHS Hazard statements: H314-H318-H400
• GHS Precautionary statements: P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501A