Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
(R)-N-((S)-(3,5-di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide
(R)-N-((S)-(3,5-di-tert-butyl-4-methoxyphenyl)(2-(diphenyl phosphanyl)phenyl)methyl)-2-methylpropane-2-sulfinamide · [S(R)]-N-[(S)-[3,5-Bis(1,1-dimethylethyl)-4-methoxyphenyl][2-(diphenylphosphino)phenyl]methyl]-2-methyl-2-propanesulfinamide · 2-Propanesulfinamide, N-[(S)-[3,5-bis(1,1-dimethylethyl)-4-methoxyphenyl][2-(diphenylphosphino)phenyl]methyl]-2-methyl-, [S(R)]-

식별자 및 물리적 특성
| CAS No. | 1616688-63-1 |
|---|---|
| 분자식 | C38H48NO2PS |
| 평균 분자량 | 613.8 g/mol |
| SMILES | COc1c(C(C)(C)C)cc([C@H](N[S@](=O)C(C)(C)C)c2ccccc2P(c2ccccc2)c2ccccc2)cc1C(C)(C)C |
| InChIKey | JIJHYOCKCFKMDP-PSBPOGMQSA-N |
화학 및 물리적 성질
| XLogP | 9.9 |
|---|---|
| 극성 표면적 | 57.5 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 4 |
| 회전 가능 결합 수 | 11 |
| 무거운 원자 수 | 43 |
| 형식 전하 | 0 |
| 복잡도 | 834 |
| 끓는 점 | 678.8±65.0 °C(Predicted) |
| pKa(산도 계수) | 10.45±0.70(Predicted) |