39k HTE dataset from Pfizer · 10.1038/s41557
查看IDENTITY
结构与身份
- 标准SMILES
- C1CCCC1.CC(C)[C@@H]1COC(C2CCCC2P(c2ccccc2)c2ccccc2)=N1.[Fe]
- InChIKey
- BGVUOLSZBHXPPO-CNGGPLSASA-N
- 分子式
- C28H38FeNOP
- 平均分子量
- 491.4 g/mol
- 单同位素质量
- 491.204037
COMPUTED
结构计算性质
- 极性表面积
- 21.6 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 5
- 重原子
- 32
- 形式电荷
- 0
- 复杂度
- 472
ALIASES
名称与别名
541540-70-9(R,Sp)-iPr-Phosferrox(R,R)-[2-(4'-I-PROPYLOXAZOLIN-2'-YL)FERROCENYL]DIPHENYLPHOSPHINEMFCD17018796C28H38FeNOPSY068661(R,R)-[2-(4 inverted exclamation mark -i-Propyloxazolin-2 inverted exclamation mark -yl)ferrocenyl]diphenylphosphinecyclopentane;iron;[2-[(4R)-4-isopropyl-4,5-dihydrooxazol-2-yl]cyclopentyl]-diphenyl-phosphane
REACTIONS
参与反应
39k HTE dataset from Pfizer · 10.1038/s41557
查看39k HTE dataset from Pfizer · 10.1038/s41557
查看39k HTE dataset from Pfizer · 10.1038/s41557
查看39k HTE dataset from Pfizer · 10.1038/s41557
查看39k HTE dataset from Pfizer · 10.1038/s41557
查看39k HTE dataset from Pfizer · 10.1038/s41557
查看39k HTE dataset from Pfizer · 10.1038/s41557
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