1. Primary Information
| English name: | Uric acid-1,3-15N2 |
| CAS No.: | 62948-75-8 |
| Molecular formula: | C5H4N4O3 |
| Molecular weight: | 170.10 g/mol |
| SMILES: | C12=C(NC(=O)N1)NC(=O)NC2=O |
| Structural class: | |
| Other identifiers: |
- |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 500mg | - | 27520 | RT | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
4. International Nomenclature & Identifiers
4.1 IUPAC Name
7,9-dihydro-3H-purine-2,6,8-trione
4.2 InChI
InChI=1S/C5H4N4O3/c10-3-1-2(7-4(11)6-1)8-5(12)9-3/h(H4,6,7,8,9,10,11,12)/i8+1,9+1
4.3 InChIKey
LEHOTFFKMJEONL-IOOOXAEESA-N
4.4 Canonical SMILES
C12=C(NC(=O)N1)NC(=O)NC2=O
4.5 Isomeric SMILES
C12=C(NC(=O)N1)[15NH]C(=O)[15NH]C2=O
4.6 SDF file
Coming soon
5. Spectroscopic data
5.1 13C nuclear magnetic resonance (13C NMR)
5.2 1H nuclear magnetic resonance (1H NMR)
5.3 Mass spectrometry (MS)
Coming soon
5.4 Infrared spectroscopy (IR)
Coming soon
5.5 Ultraviolet/visible spectroscopy (UV/Vis)
Coming soon
