HRID143593
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D
查看条件与参与物IDENTITY
结构与身份
- 标准 SMILES
- Fc1ccc(C(CCCBr)c2ccc(F)cc2)cc1
- InChIKey
- AJHQYQYRIDMWON-UHFFFAOYSA-N
- 分子式
- C16H15BrF2
- 平均分子量
- 325.19 g/mol
- 单同位素质量
- 324.03252
COMPUTED
结构计算性质
- XLogP
- 5.3
- 极性表面积
- 0 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 5
- 重原子
- 19
- 形式电荷
- 0
- 复杂度
- 221
物化、安全与法规信息正在同步。
ALIASES
名称与别名
57668-61-81,1'-(4-Bromobutylidene)bis(4-fluorobenzene)1,1'-(4-bromobutylidene)bis[4-fluorobenzene]EINECS 260-890-3Z7ZG44C3HPDTXSID30206371BENZENE, 1,1'-(4-BROMOBUTYLIDENE)BIS(4-FLUORO-RefChem:70737DTXCID30128862260-890-31-[4-bromo-1-(4-fluorophenyl)butyl]-4-fluorobenzeneUNII-Z7ZG44C3HPSCHEMBL58641614,4-bis(4-fluorophenyl)butyl bromideDB-322487NS000525421,1'-(4-bromobutane-1,1-diyl)bis(4-fluorobenzene)
REACTIONS
参与反应
HRID294693
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看条件与参与物HRID701860
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D
查看条件与参与物HRID963982
uspto-grants-1998_06
作为反应物
uspto-grants-1998_06 · 10.6084/m9.figshare.5104873.v1 · US05767129
查看条件与参与物HRID990325
uspto-grants-2002_10
作为反应物
uspto-grants-2002_10 · 10.6084/m9.figshare.5104873.v1 · US06458781B1
查看条件与参与物HRID1226983
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
作为反应物
Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D
查看条件与参与物HRID1584102
uspto-grants-1999_08
作为反应物
uspto-grants-1999_08 · 10.6084/m9.figshare.5104873.v1 · US05932573
查看条件与参与物HRID1796785
uspto-grants-2006_04
作为反应物
uspto-grants-2006_04 · 10.6084/m9.figshare.5104873.v1 · US07030120B2
查看条件与参与物