SB 204990
- Product NameSB 204990
- CAS154566-12-8
- CBNumberCB51363884
- MFC18H22Cl2O5
- MW389.27
- MOL File154566-12-8.mol
- MSDS FileSDS
Chemical Properties
| Melting point | 87-89 °C |
| Boiling point | 571.6±40.0 °C(Predicted) |
| Density | 1.332±0.06 g/cm3(Predicted) |
| solubility | DMF: 30 mg/ml; DMF:PBS(pH7.2) (1:2): 0.33 mg/ml; DMSO: 20 mg/ml; Ethanol: 1 mg/ml |
| form | A crystalline solid |
| pka | 4.33±0.10(Predicted) |
| InChI | InChI=1/C18H22Cl2O5/c19-13-8-7-12(15(20)9-13)5-3-1-2-4-6-14-10-18(24,11-16(21)22)17(23)25-14/h7-9,14,24H,1-6,10-11H2,(H,21,22)/t14-,18+/s3 |
| InChIKey | YTRNLFYTHYWDAU-RVFWCEGZNA-N |
| SMILES | O1[C@@H](CCCCCCC2=CC=C(Cl)C=C2Cl)C[C@@](O)(CC(O)=O)C1=O |&1:1,17,r| |