sulfuric acid di(15N)amine

• ChemBase ID: 135772
• Molecular Formular: H8N2O4S
• Molecular Mass: 134.1263378
• Monoisotopic Mass: 134.01454753
• SMILES: [15NH3].[15NH3].OS(=O)(=O)O
• Canonical SMILES: OS(=O)(=O)O.[15NH3].[15NH3]
• InChI: InChI=1S/2H3N.H2O4S/c;;1-5(2,3)4/h2*1H3;(H2,1,2,3,4)/i2*1+1
• InChIKey: BFNBIHQBYMNNAN-ISOLYIDJSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: sulfuric acid di(^1^5N)amine
• IUPAC Traditional name: sulfuric acid di(^1^5N)amine
• Synonyms: 15N Labeled ammonium sulfate; Diazanium-15N2 sulfate; Ammonium-15N2 sulfate; 硫酸铵-15N2

Database IDs

• CAS Number: 43086-58-4
• MDL Number: MFCD00003392
• PubChem SID: 24858031; 24861577; 162230044; 24872329; 24872330
• PubChem CID: 53393618

CALCULATED PROPERTIES

• Acid pKa: -3.034349
• H Acceptors: 4
• H Donor: 2
• LogD (pH = 5.5): -5.569452
• LogD (pH = 7.4): -5.594027
• Log P: -0.841552
• Molar Refractivity: 13.7708 cm^3
• Polarizability: 6.279968 Å^3
• Polar Surface Area: 74.6 Å^2
• Rotatable Bonds: 0
• Lipinski's Rule of Five: true

PROPERTIES

Physical Property

• Melting Point: >280 °C (dec.)(lit.)
• Mass Shift: M+2

Safety Information

• German water hazard class: 1
• Personal Protective Equipment: Eyeshields, Gloves, type N95 (US), type P1 (EN143) respirator filter

Product Information

• Isotopic Purity: 10 atom % 15N; 15 atom % 15N; 2 atom % 15N; 20 atom % 15N; 30 atom % 15N; 5 atom % 15N; 60 atom % 15N; 98 atom % 15N
• Mol. Weight: mol wt 132.17 by atom % calculation; mol wt 132.24 by atom % calculation; mol wt 132.34 by atom % calculation; mol wt 132.44 by atom % calculation; mol wt 132.54 by atom % calculation; mol wt 132.74 by atom % calculation; mol wt 133.34 by atom % calculation; mol wt 134.09 by atom % calculation
• Linear Formula: (15NH4)2SO4

DETAILS

Sigma Aldrich - 488097

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 - 348473

Packaging
5, 25 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 - 488089

Packaging
250 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 - 609404

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 - 633852

Packaging
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Sigma Aldrich - 609420

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 - 299286

Packaging
1, 10, 20 g in glass bottle
250 mg 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 - 609447

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.