Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
5-(4-FLUOROPHENYL)-3-HYDROXY-2-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-4-(1H-1,2,4-TRIAZOL-1-YL)-2-CYCLOHEXEN-1-ONE
5-(4-fluorophenyl)-3-hydroxy-2-(1,2,3,4-tetrahydroisoquinolin-1-yl)-4-(1H-1,2,4-triazol-1-yl)cyclohex-2-en-1-one · 5-(4-FLUOROPHENYL)-3-HYDROXY-2-(1,2,3,4-TETRAHYDRO-1-ISOQUINOLINYL)-4-(1H-1,2,4-TRIAZOL-1-YL)-2-CYCLOHEXEN-1-ONE · 2-Cyclohexen-1-one, 5-(4-fluorophenyl)-3-hydroxy-2-(1,2,3,4-tetrahydro-1-isoquinolinyl)-4-(1H-1,2,4-triazol-1-yl)- · 4'-fluoro-5-hydroxy-4-(1,2,3,4-tetrahydroisoquinolin-1-yl)-6-(1H-1,2,4-triazol-1-yl)-1,6-dihydro-[1,1'-biphenyl]-3(2H)-one

식별자 및 물리적 특성
| CAS No. | 1005106-96-6 |
|---|---|
| 분자식 | C23H21FN4O2 |
| 평균 분자량 | 404.44 g/mol |
| SMILES | O=C1CC(c2ccc(F)cc2)C(n2cncn2)C(O)=C1C1NCCc2ccccc21 |
| InChIKey | FXLNDTHFEDSOJP-UHFFFAOYSA-N |
화학 및 물리적 성질
| 끓는 점 | 634.9±65.0 °C(Predicted) |
|---|---|
| 밀도 | 1.43±0.1 g/cm3(Predicted) |
| pKa(산도 계수) | 2.14±0.58(Predicted) |