nitric acid (15N)amine

• ChemBase ID: 135277
• Molecular Formular: H4N2O3
• Molecular Mass: 81.0367689
• Monoisotopic Mass: 81.01922689
• SMILES: [15NH3].[N+](=O)(O)[O-]
• Canonical SMILES: [O-][N+](=O)O.[15NH3]
• InChI: InChI=1S/HNO3.H3N/c2-1(3)4;/h(H,2,3,4);1H3/i;1+1
• InChIKey: PRORZGWHZXZQMV-IEOVAKBOSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: nitric acid (^1^5N)amine
• IUPAC Traditional name: acid, nitric (^1^5N)amine
• Synonyms: Ammonium-15N nitrate

Database IDs

• CAS Number: 31432-48-1
• MDL Number: MFCD00064510
• PubChem SID: 24872323; 162229552; 24858030; 24882015
• PubChem CID: 71309194

CALCULATED PROPERTIES

• Acid pKa: -1.3999903
• H Acceptors: 3
• H Donor: 1
• LogD (pH = 5.5): -2.3479722
• LogD (pH = 7.4): -2.3479848
• Log P: 0.028413763
• Molar Refractivity: 10.473 cm^3
• Polarizability: 3.677472 Å^3
• Polar Surface Area: 66.05 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: 169 °C(lit.)
• Boiling Point: 210 °C(lit.)
• Mass Shift: M+1

Safety Information

• European Hazard Symbols: Oxidising (O); Irritant (Xi)
• UN Number: 1942
• German water hazard class: 3
• Hazard Class: 5.1
• Packing Group: 3
• Risk Statements: 8-36/37/38
• Safety Statements: 15-17-26-36
• GHS Pictograms: GHS03; GHS07
• GHS Signal Word: Warning
• GHS Hazard statements: H272-H315-H319-H335
• GHS Precautionary statements: P220-P261-P305 + P351 + P338
• Personal Protective Equipment: dust mask type N95 (US), Eyeshields, full-face particle respirator type N100 (US), Gloves, respirator cartridge type N100 (US), type P1 (EN143) respirator filter, type P3 (EN 143) respirator cartridges; Eyeshields, 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 1942 5.1/PG 3

Product Information

• Grade: puriss.
• Isotopic Purity: ≥99.0 atom % 15N; 10 atom % 15N; 5 atom % 15N; 60 atom % 15N; 98 atom % 15N
• Mol. Weight: mol wt 80.09 by atom % calculation; mol wt 80.14 by atom % calculation; mol wt 80.64 by atom % calculation; mol wt 81.02 by atom % calculation
• Linear Formula: 15NH4NO3

DETAILS

Sigma Aldrich - 299278

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.

Sigma Aldrich - 488046

Packaging
50 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.

Sigma Aldrich - 609455

Packaging
5 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.

Sigma Aldrich - 488038

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.