1. Primary Information
| English name: | Acid red 1 |
| CAS No.: | 3734-67-6 |
| Molecular formula: | C18H13N3NA2O8S2 |
| Molecular weight: | 509.4 g/mol |
| SMILES: | CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(C(=C2O)N=NC3=CC=CC=C3)S(=O)(=O)[O-].[Na+].[Na+] |
| Structural class: | |
| Other identifiers: |
azofloxin azophloxine benzeneazo-8-acetylamino-1-naphthol-3,6-disulfonic acid, sodium salt C.I. 18050 red 2G |
2. Suppliers & Pricing
| Supplier | Pack size | Purity | Price (CNY) | Storage conditions | Lead time | Notes |
| Kehua Intelligence | 25g | FMP | 40 | RT | in stock | - |
| Kehua Intelligence | 100g | FMP | 144 | RT | in stock | - |
| Kehua Intelligence | 500g | FMP | 480 | RT | in stock | - |
3. Structures
3.1 2D structure
3.2 3D structure
Coming soon
4. International Nomenclature & Identifiers
4.1 IUPAC Name
disodium;5-acetamido-4-hydroxy-3-phenyldiazenylnaphthalene-2,7-disulfonate
4.2 InChI
InChI=1S/C18H15N3O8S2.2Na/c1-10(22)19-14-9-13(30(24,25)26)7-11-8-15(31(27,28)29)17(18(23)16(11)14)21-20-12-5-3-2-4-6-12;;/h2-9,23H,1H3,(H,19,22)(H,24,25,26)(H,27,28,29);;/q;2*+1/p-2
4.3 InChIKey
WXLFIFHRGFOVCD-UHFFFAOYSA-L
4.4 Canonical SMILES
CC(=O)NC1=C2C(=CC(=C1)S(=O)(=O)[O-])C=C(C(=C2O)N=NC3=CC=CC=C3)S(=O)(=O)[O-].[Na+].[Na+]
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
-- No 3D model data available --
