Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
1-(2,3-디데옥시-2-플루오로펜토푸라노실)-5-플루오로시토신
1-(2,3-디데옥시-2-플루오로펜토푸라노실)-5-플루오로시토신 · 1-(2,3-dideoxy-2-fluoropentofuranosyl)-5-fluorocytosine · 1-(2,3-dideoxy-2-fluoro-β-D-theropentofuranosyl)-5-fluorocytosine · 1-(2,3-Dideoxy-2-fluoro-β-D-threo-pentofuranosyl)-5-fluorocytosine · 4-Amino-1-(2-fluoro-2,3-dideoxy-β-D-threo-pentofuranosyl)-5-fluoro-2(1H)-pyrimidinone
식별자 및 물리적 특성
| CAS No. | 128496-09-3 |
|---|---|
| 분자식 | C9H11F2N3O3 |
| 평균 분자량 | 247.201 g/mol |
| 단동위원소 질량 | 247.07684765 g/mol |
| SMILES | Nc1nc(=O)n([C@@H]2O[C@H](CO)C[C@@H]2F)cc1F |
| InChIKey | PQIIAWFMYCQACX-ZVQZEWSASA-N |
| PubChem CID | 452213 |
| DTXSID | DTXSID00926150 |
| 현지명 | 1-(2,3-디데옥시-2-플루오로펜토푸라노실)-5-플루오로시토신 |
화학 및 물리적 성질
| 녹는점 | 195-196 °C |
|---|---|
| 끓는 점 | 389.493±52.00 °C(Press: 760.00 Torr)(predicted) |
| 밀도 | 1.770±0.14 g/cm3(Temp: 25 °CPress: 760 Torr)(predicted) |
| pKa(산도 계수) | 14.438±0.10(predicted) |