9-Methylxanthine
- Product Name9-Methylxanthine
- CAS1198-33-0
- CBNumberCB1484025
- MFC6H6N4O2
- MW166.14
- EINECS214-831-3
- MDL NumberMFCD00042774
- MOL File1198-33-0.mol
- MSDS FileSDS
Chemical Properties
| Melting point | >300 °C |
| solubility | 0.1 M NaOH: soluble |
| form | powder |
| pka | pK1:6.25 (25°C) |
| BRN | 170467 |
| InChI | 1S/C6H6N4O2/c1-10-2-7-3-4(10)8-6(12)9-5(3)11/h2H,1H3,(H2,8,9,11,12) |
| InChIKey | DHNIKYWYTSMDDA-UHFFFAOYSA-N |
| SMILES | Cn1cnc2C(=O)NC(=O)Nc12 |
| FDA UNII | 13HCS9N24R |
| UNSPSC Code | 12352100 |
| NACRES | NA.22 |
Safety
| Hazard Codes | T+ |
| Risk Statements | 26/27/28 |
| Safety Statements | 22-24/25 |
| WGK Germany | 3 |
| Storage Class | 13 - Non Combustible Solids |