
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 57935-65-6 |
| Catalog No. | 2A-1179369 |
| Chinese Name | 尼麦角林EP杂质G |
| Molecular Formula | C23H24BrN3O2 |
| Molecular Weight | 454.37 |
| Purity | 98.00 |
| Density | 1.50±0.1 g/cm3(Predicted) |
| Boiling Point | 583.8±45.0 °C(Predicted) |
| PubChem ID | 470655719 |
| SMILES | CN1CC(COC(=O)c2cncc(Br)c2)CC2c3cccc4c3c(cn4C)CC21 |
| InChI | InChI=1S/C23H24BrN3O2/c1-26-11-14(13-29-23(28)15-7-17(24)10-25-9-15)6-19-18-4-3-5-20-22(18)16(8-21(19)26)12-27(20)2/h3-5,7,9-10,12,14,19,21H,6,8,11,13H2,1-2H3/t14-,19-,21-/m1/s1 |
| InChI Key | JSOSQCRIXCEVRN-YFZFPPMRSA-N |
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