(2E)-1-[5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one
Modify Date: 2025-08-28 20:35:28
![(2E)-1-[5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one Structure](https://image.chemsrc.com/caspic/047/1253056-18-6.png)
(2E)-1-[5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one structure
|
Common Name | (2E)-1-[5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one | ||
|---|---|---|---|---|
| CAS Number | 1253056-18-6 | Molecular Weight | 390.283 | |
| Density | 1.5±0.1 g/cm3 | Boiling Point | 517.5±60.0 °C at 760 mmHg | |
| Molecular Formula | C16H12F6N4O | Melting Point | N/A | |
| MSDS | N/A | Flash Point | 266.8±32.9 °C | |
| Name | (2E)-1-[3-(Trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one |
|---|---|
| Synonym | More Synonyms |
| Density | 1.5±0.1 g/cm3 |
|---|---|
| Boiling Point | 517.5±60.0 °C at 760 mmHg |
| Molecular Formula | C16H12F6N4O |
| Molecular Weight | 390.283 |
| Flash Point | 266.8±32.9 °C |
| Exact Mass | 390.091522 |
| LogP | 1.73 |
| Vapour Pressure | 0.0±1.3 mmHg at 25°C |
| Index of Refraction | 1.565 |
| InChIKey | QSSHJJFVCWMIKH-HNQUOIGGSA-N |
| SMILES | O=C(C=CCc1cc(F)c(F)cc1F)N1CCn2c(nnc2C(F)(F)F)C1 |
| Water Solubility | Insuluble (3.4E-3 g/L) (25 ºC) |
| 2-Buten-1-one, 1-[5,6-dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-, (2E)- |
| (2E)-1-[3-(Trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one |
| (2E)-1-[5,6-Dihydro-3-(trifluoromethyl)-1,2,4-triazolo[4,3-a]pyrazin-7(8H)-yl]-4-(2,4,5-trifluorophenyl)-2-buten-1-one |
| Sitagliptin Impurity 17 |