
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 1239662-46-4 |
| Catalog No. | 2A-0202143 |
| Chinese Name | 磷酸泰迪唑胺杂质 06 |
| Synonyms | Exact Mass 388.085083; LogP 2.83; Index of Refraction 1.716; InChIKey XBEWJWSQISOVRV-UHFFFAOYSA-N; Synonyms |
| Molecular Formula | C17H15O3N6F1 |
| Molecular Weight | 370.34 |
| Density | 1.6±0.1 g/cm3 |
| Boiling Point | 601.9±65.0 °C at 760 mmHg |
| Water Solubility | Insuluble (6.2E-3 g/L) (25 ºC) |
| PubChem ID | 229132977 |
| MDL Number | MFCD19442562 |
| SMILES | Cn1nnc(-c2ccc(-c3ccc(N4CC(CCl)OC4=O)cc3F)cn2)n1 |
| InChI | InChI=1S/C17H14ClFN6O2/c1-24-22-16(21-23-24)15-5-2-10(8-20-15)13-4-3-11(6-14(13)19)25-9-12(7-18)27-17(25)26/h2-6,8,12H,7,9H2,1H3 |
| InChI Key | XBEWJWSQISOVRV-UHFFFAOYSA-N |
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