Kehua AI (Shenzhen) Innovative Drug R&D Co., Ltd.    Healthy Roots Biotechnology (Shenzhen) Co., Limited    Joint Development

1. Primary Information

English name: Cyanuric acid
CAS No.: 108-80-5
Molecular formula: C3H3N3O3
Molecular weight: 129.07 g/mol
SMILES: C1(=O)NC(=O)NC(=O)N1
Structural class:
Other identifiers:

cyanuric acid

cyanuric acid, cupric ammonia (+2) salt

cyanuric acid, disodium salt

cyanuric acid, monopotassium salt

cyanuric acid, monosodium salt

2. Suppliers & Pricing

Supplier Pack size Purity Price (CNY) Storage conditions Lead time Notes
Kehua Intelligence 250mg 99% 280 2-8℃ in stock -
Kehua Intelligence 100g CP,98% 32 2-8℃ in stock -
Kehua Intelligence 500g CP,98% 96 2-8℃ in stock -

3. Structures

3.1 2D structure


3.2 3D structure


4. International Nomenclature & Identifiers

4.1 IUPAC Name

1,3,5-triazinane-2,4,6-trione


4.2 InChI

InChI=1S/C3H3N3O3/c7-1-4-2(8)6-3(9)5-1/h(H3,4,5,6,7,8,9)


4.3 InChIKey

ZFSLODLOARCGLH-UHFFFAOYSA-N


4.4 Canonical SMILES

C1(=O)NC(=O)NC(=O)N1


4.5 Isomeric SMILES

-

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