ML115
- Product NameML115
- CAS912798-42-6
- CBNumberCB93152682
- MFC15H15ClN2O4
- MW322.7436
- MDL NumberMFCD09782805
- MOL File912798-42-6.mol
- MSDS FileSDS
Chemical Properties
| Boiling point | 422.9±45.0 °C(Predicted) |
| Density | 1.389±0.06 g/cm3(Predicted) |
| storage temp. | Store at -20°C |
| solubility | DMF: 25 mg/ml; DMSO: 16 mg/ml; Ethanol: 0.1 mg/ml |
| form | A crystalline solid |
| pka | 9.26±0.70(Predicted) |
| color | White to off-white |
| InChI | InChI=1S/C15H15ClN2O4/c1-20-13-6-10(14(21-2)5-9(13)16)17-15(19)11-7-12(22-18-11)8-3-4-8/h5-8H,3-4H2,1-2H3,(H,17,19) |
| InChIKey | FMWABCRYNLCXOJ-UHFFFAOYSA-N |
| SMILES | O1C(C2CC2)=CC(C(NC2=CC(OC)=C(Cl)C=C2OC)=O)=N1 |
