Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- Fc1cccc(OCCCBr)c1
- InChIKey
- QDJZOJMIOHRCRH-UHFFFAOYSA-N
- 分子式
- C9H10BrFO
- 平均分子量
- 233.08 g/mol
- 单同位素质量
- 231.98991
COMPUTED
结构计算性质
- XLogP
- 3.1
- 极性表面积
- 9.2 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 4
- 重原子
- 12
- 形式电荷
- 0
- 复杂度
- 121
物化、安全与法规信息正在同步。
ALIASES
名称与别名
1-(3-bromopropoxy)-3-fluorobenzene193356-97-73-bromopropoxy-3-fluorobenzeneSCHEMBL3078682SCHEMBL30674754QDJZOJMIOHRCRH-UHFFFAOYSA-N3-bromopropyl 3-fluorophenyl etherEN300-1897458A1-19502
REACTIONS
相关反应
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