[(2H)hydroxy](2H2)amine; chloro(2H)

• ChemBase ID: 137663
• Molecular Formular: ClH4NO
• Molecular Mass: 69.49086
• Monoisotopic Mass: 68.99814143
• SMILES: NO.Cl
• Canonical SMILES: NO.Cl
• InChI: InChI=1S/ClH.H3NO/c;1-2/h1H;2H,1H2
• InChIKey: WTDHULULXKLSOZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: [(^2H)hydroxy](^2H₂)amine; chloro(^2H)
• IUPAC Traditional name: [(^2H)hydroxy](^2H₂)amine; chloro(^2H)
• Synonyms: Hydroxylamine-d3 deuteriochloride; 羟胺-d3 氯化氘

Database IDs

• CAS Number: 15588-23-5
• MDL Number: MFCD00075189
• PubChem SID: 162231925; 24860809
• PubChem CID: 16212195

CALCULATED PROPERTIES

• Acid pKa: 17.64608
• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -0.7521895
• LogD (pH = 7.4): -0.7406456
• Log P: -0.7404964
• Molar Refractivity: 7.8487 cm^3
• Polarizability: 2.9881976 Å^3
• Polar Surface Area: 46.25 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 156-158 °C(lit.)
• Mass Shift: M+4

Safety Information

• European Hazard Symbols: Explosive (E); Nature polluting (N); Harmful (Xn)
• UN Number: 2923
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 2-21/22-36/38-40-43-48/22-50
• Safety Statements: 36/37-61
• GHS Pictograms: GHS05; GHS07; GHS08; GHS09
• GHS Signal Word: Warning
• GHS Hazard statements: H290-H302-H312-H315-H317-H319-H351-H373-H400
• GHS Precautionary statements: P273-P280-P305 + P351 + P338
• RID/ADR: UN 2923 8/PG 2

Product Information

• Isotopic Purity: 98 atom % D
• Linear Formula: D2NOD·DCl

DETAILS

Sigma Aldrich - 340413

Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.