Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看![Diethyl 2-[bis(3,5-di-t-butyl-4-methoxyphenyl)phosphino]phenylphosphonite 分子结构式](/api/mol/12115811/svg/360x280.svg)
IDENTITY
结构与身份
- 标准SMILES
- CCOP(OCC)c1ccccc1P(c1cc(C(C)(C)C)c(OC)c(C(C)(C)C)c1)c1cc(C(C)(C)C)c(OC)c(C(C)(C)C)c1
- InChIKey
- CWAMZERHFCCDMQ-UHFFFAOYSA-N
- 分子式
- C40H60O4P2
- 平均分子量
- 666.8 g/mol
- 单同位素质量
- 666.39668439
COMPUTED
结构计算性质
- XLogP
- 11.6
- 极性表面积
- 36.9 Ų
- 氢键供体
- 0
- 氢键受体
- 4
- 可旋转键
- 14
- 重原子
- 46
- 形式电荷
- 0
- 复杂度
- 802
ALIASES
名称与别名
SCHEMBL6761505CWAMZERHFCCDMQ-UHFFFAOYSA-Ndiethyl 2-[bis(3,5-di-t-butyl-4-methoxyphenyl)phosphino]phenylphosphonite
REACTIONS
参与反应
Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
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uspto-grants-2004_05 · 10.6084/m9.figshare.5104873.v1 · US06730629B2
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uspto-grants-2004_05 · 10.6084/m9.figshare.5104873.v1 · US06730629B2
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uspto-grants-2004_05 · 10.6084/m9.figshare.5104873.v1 · US06730629B2
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uspto-grants-2004_05 · 10.6084/m9.figshare.5104873.v1 · US06730629B2
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