sodium (2H)

• ChemBase ID: 147359
• Molecular Formular: NaO
• Molecular Mass: 38.98917
• Monoisotopic Mass: 38.9846839
• SMILES: [OH-].[Na+]
• Canonical SMILES: [OH-].[Na+]
• InChI: InChI=1S/Na.H2O/h;1H2/q+1;/p-1
• InChIKey: HEMHJVSKTPXQMS-UHFFFAOYSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: sodium (^2H)
• IUPAC Traditional name: sodium water-d1
• Synonyms: Sodium deuteroxide solution; Sodium hydroxide-d; Sodium deuteroxide; Sodium hydroxide, deuterated; 氘代氢氧化钠; 氘氧化钠 溶液; 氘氧化钠

Database IDs

• CAS Number: 14014-06-3
• EC Number: 237-825-2
• MDL Number: MFCD00037669
• PubChem SID: 24850600; 24850076; 24863146; 162241548
• PubChem CID: 23676750

CALCULATED PROPERTIES

• Acid pKa: 15.7
• H Acceptors: 1
• H Donor: 1
• LogD (pH = 5.5): -0.652
• LogD (pH = 7.4): -0.652
• Log P: -0.652
• Molar Refractivity: 13.9149 cm^3
• Polarizability: 1.1434737 Å^3
• Polar Surface Area: 0.0 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Apperance: Liquid
• Density: 1.462; 1.516
• Refractive Index: 1.4039; 1.4180; n20/D 1.4039; n20/D 1.418; n20/D 1.4196
• Mass Shift: M+1

Safety Information

• Storage Warning: Air & Moisture Sensitive
• European Hazard Symbols: Corrosive (C)
• UN Number: 1824; UN1824
• German water hazard class: 3
• Hazard Class: 8
• Packing Group: 2; II
• Risk Statements: 35
• Safety Statements: 26-36/37/39-45; 26-37/39-45
• TSCA Listed: 否
• GHS Pictograms: GHS05; GHS06
• GHS Signal Word: Danger
• GHS Hazard statements: H300-H314-H318; H314
• GHS Precautionary statements: P260-P301+P310-P303+P361+P353-P305+P351+P338-P405-P501A; P280-P305 + P351 + P338-P310
• Personal Protective Equipment: Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
• RID/ADR: UN 1824 8/PG 2

Product Information

• Purity: 30% w/w solution in D2O, 99.5% (Isotopic); 40% w/w solution in D2O, 99.5%(Isotopic)
• Concentration: 30 wt. % in D2O; 40 wt. % in D2O
• Isotopic Purity: 99 atom % D; 99.5 atom % D
• Mol. Weight: mol wt 40.99 by atom % calculation; mol wt 41.00 by atom % calculation
• Linear Formula: NaOD / D2O

DETAILS

Sigma Aldrich - 176788

Packaging
10, 50, 100 g in poly bottle

Sigma Aldrich - 164488

Packaging
20 g in poly bottle

Sigma Aldrich - 372072

Packaging
10, 50 g in poly bottle