(2H4)hydrazine; [(2H)oxy](2H)

• ChemBase ID: 135028
• Molecular Formular: H6N2O
• Molecular Mass: 50.06044
• Monoisotopic Mass: 50.04801282
• SMILES: NN.O
• Canonical SMILES: NN.O
• InChI: InChI=1S/H4N2.H2O/c1-2;/h1-2H2;1H2
• InChIKey: IKDUDTNKRLTJSI-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (^2H₄)hydrazine; [(^2H)oxy](^2H)
• IUPAC Traditional name: (^2H₄)hydrazine; deuterium oxide
• Synonyms: Hydrazine-d4 deuterate; Hydrazine-d4 monodeuterate; 氘代肼-d4; 肼-d4 单氘化合物

Database IDs

• CAS Number: 102096-80-0
• MDL Number: MFCD01074336
• PubChem SID: 24882134; 162229303
• PubChem CID: 16217612

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 2
• LogD (pH = 5.5): -1.2863406
• LogD (pH = 7.4): -1.0380839
• Log P: -1.0337903
• Molar Refractivity: 10.5682 cm^3
• Polarizability: 3.5840569 Å^3
• Polar Surface Area: 52.04 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: -51.7 °C(lit.)
• Boiling Point: 120.1 °C(lit.)
• Flash Point: 165.2 °F; 74 °C
• Density: 1.156 g/mL at 25 °C
• Refractive Index: n20/D 1.428
• Mass Shift: M+6

Safety Information

• European Hazard Symbols: Nature polluting (N); Toxic (T)
• UN Number: 2030
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2
• Risk Statements: 45-10-23/24/25-34-43-50/53
• Safety Statements: 53-45-60-61
• GHS Pictograms: GHS02; GHS05; GHS06; GHS08; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H226-H301-H311-H314-H317-H331-H350-H410
• GHS Precautionary statements: P201-P261-P273-P280-P301 + P310-P305 + P351 + P338
• RID/ADR: UN 2030 8/PG 2

Product Information

• Isotopic Purity: 98 atom % D
• Mol. Weight: mol wt 55.98 by atom % calculation
• Linear Formula: D2NND2•D2O

DETAILS

Sigma Aldrich - 614009

Packaging
20 g in glass bottle
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.