| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1346603-86-8 |
| Catalog No. | 2A-3180180 |
| Chinese Name | 利培酮杂质 F |
| Synonyms | Exact Mass 454.201630; LogP 2.85; Index of Refraction 1.672; InChIKey XDVWOEVAHOSPOO-UHFFFAOYSA-N; Synonyms |
| Molecular Formula | C18H15Cl4N3O4 |
| Molecular Weight | 454.494 |
| Density | 1.4±0.1 g/cm3 |
| Boiling Point | 620.3±65.0 °C at 760 mmHg |
| Water Solubility | Insuluble (5.0E-3 g/L) (25 ºC) |
| PubChem ID | 164233469 |
| SMILES | Cc1nc2n(c(=O)c1CCOC(=O)N1CCC(c3noc4cc(F)ccc34)CC1)CCCC2 |
| InChI | InChI=1S/C24H27FN4O4/c1-15-18(23(30)29-10-3-2-4-21(29)26-15)9-13-32-24(31)28-11-7-16(8-12-28)22-19-6-5-17(25)14-20(19)33-27-22/h5-6,14,16H,2-4,7-13H2,1H3 |
| InChI Key | XDVWOEVAHOSPOO-UHFFFAOYSA-N |
| NACRES Code | NA.24 |
| UNSPSC | 41116107 |
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