Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
ethyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate
TIMTEC-BB SBB001153 · Ethyl 6-amino-5-cyano-2-methyl-4-phenyl-4H-pyran-3-carboxylate · 6-AMINO-5-CYANO-2-METHYL-4-PHENYL-4H-PYRAN-3-CARBOXYLIC ACID ETHYL ESTER · 4H-Pyran-3-carboxylic acid, 6-amino-5-cyano-2-methyl-4-phenyl-, ethyl ester
식별자 및 물리적 특성
| CAS No. | 72568-47-9 |
|---|---|
| 분자식 | C16H16N2O3 |
| 평균 분자량 | 284.315 g/mol |
| 단동위원소 질량 | 284.11609237 g/mol |
| SMILES | CCOC(=O)C1=C(C)OC(N)=C(C#N)C1c1ccccc1 |
| InChIKey | XTMWVOYEFHWDDN-UHFFFAOYSA-N |
| PubChem CID | 2779708 |
| ChEMBL | CHEMBL1087042 |
| EC No. | 151-402-9 |
| DTXSID | DTXSID30381511 |
화학 및 물리적 성질
| 녹는점 | 465-467 °C |
|---|---|
| 끓는 점 | 497.2±45.0 °C(Predicted) |
| 밀도 | 1.24±0.1 g/cm3(Predicted) |
| pKa(산도 계수) | 2.82±0.70(Predicted) |