53746-45-5
| Name | Fenoprofen calcium |
| CAS | 53746-45-5 |
| EINECS(EC#) | 628-664-2 |
| Molecular Formula | C30H30CaO8 |
| MDL Number | MFCD00242722 |
| Molecular Weight | 558.63 |
| MOL File | 53746-45-5.mol |
Chemical Properties
| Melting point | >94oC (dec.) |
| storage temp. | Hygroscopic, -20°C Freezer, Under inert atmosphere |
| solubility | Chloroform (Slightly, Heated, Sonicated), DMSO (Slightly) |
| form | neat |
| pka | 4.5(at 25℃) |
| color | White to Off-White |
| Stability: | Hygroscopic |
| Major Application | forensics and toxicology pharmaceutical (small molecule) veterinary |
| InChI | 1S/C15H14O3.Ca.H2O.2H/c1-11(15(16)17)12-6-5-9-14(10-12)18-13-7-3-2-4-8-13;;;;/h2-11H,1H3,(H,16,17);;1H2;; |
| InChIKey | JWCQUXFJNIIYQZ-UHFFFAOYSA-N |
| SMILES | O.[Ca].CC(C(O)=O)c1cccc(Oc2ccccc2)c1 |
| CAS DataBase Reference | 53746-45-5(CAS DataBase Reference) |
Safety Data
| Hazard Codes | Xn |
| Risk Statements | |
| Safety Statements | |
| WGK Germany | 3 |
| RTECS | CY1678900 |
| HS Code | 2918992090 |
| Storage Class | 11 - Combustible Solids |
| Hazard Classifications | Acute Tox. 4 Dermal Acute Tox. 4 Inhalation Acute Tox. 4 Oral |
| Toxicity |