sodium (15N)nitrite

• ChemBase ID: 147182
• Molecular Formular: NNaO2
• Molecular Mass: 69.9886789
• Monoisotopic Mass: 69.97970742
• SMILES: [15N](=O)[O-].[Na+]
• Canonical SMILES: [O-][15N]=O.[Na+]
• InChI: InChI=1S/HNO2.Na/c2-1-3;/h(H,2,3);/q;+1/p-1/i1+1
• InChIKey: LPXPTNMVRIOKMN-YTBWXGASSA-M

NAMES AND DATABASE IDS

Names

• IUPAC name: sodium (^1^5N)nitrite
• IUPAC Traditional name: sodium (^1^5N)nitrite
• Synonyms: Sodium nitrite-15N; 亚硝酸钠-15N

Database IDs

• CAS Number: 68378-96-1
• MDL Number: MFCD00084241
• PubChem SID: 162241373; 24872602
• PubChem CID: 23662135

CALCULATED PROPERTIES

• Acid pKa: 3.3200002
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): -1.8028829
• LogD (pH = 7.4): -2.2017875
• Log P: 0.16613764
• Molar Refractivity: 7.6 cm^3
• Polarizability: 2.4691868 Å^3
• Polar Surface Area: 52.49 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 271 °C(lit.)
• Mass Shift: M+1

Safety Information

• European Hazard Symbols: Nature polluting (N); Oxidising (O); Toxic (T)
• UN Number: 1500
• German water hazard class: 2
• Hazard Class: 5.1
• Packing Group: 3
• Risk Statements: 8-25-50
• Safety Statements: 45-61
• GHS Pictograms: GHS03; GHS06; GHS09
• GHS Signal Word: Danger
• GHS Hazard statements: H272-H301-H400
• GHS Precautionary statements: P220-P273-P301 + P310
• Personal Protective Equipment: Eyeshields, Faceshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges
• RID/ADR: UN 1500 5.1/PG 3

Product Information

• Purity: 95% (CP)
• Isotopic Purity: 98 atom % 15N
• Mol. Weight: mol wt 69.97 by atom % calculation
• Linear Formula: Na15NO2

DETAILS

Sigma Aldrich - 490814

Packaging
1 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.