Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D
查看IDENTITY
结构与身份
- 标准SMILES
- CC(C)Oc1cccc(Br)c1
- InChIKey
- JYWJZIQSPRFCDB-UHFFFAOYSA-N
- 分子式
- C9H11BrO
- 平均分子量
- 215.09 g/mol
- 单同位素质量
- 213.99933
COMPUTED
结构计算性质
- XLogP
- 3.4
- 极性表面积
- 9.2 Ų
- 氢键供体
- 0
- 氢键受体
- 1
- 可旋转键
- 2
- 重原子
- 11
- 形式电荷
- 0
- 复杂度
- 114
物化、安全与法规信息正在同步。
ALIASES
名称与别名
1-Bromo-3-isopropoxybenzene131738-73-31-bromo-3-(propan-2-yloxy)benzeneDTXSID90390760RefChem:430484DTXCID40341621628-160-23-Bromophenyl isopropyl ether3-bromoisoproproxylbenzene1-bromo-3-propan-2-yloxybenzene2-(3-Bromophenoxy)propaneMFCD000707563-bromo-isopropoxybenzeneBenzene, 1-bromo-3-(1-methylethoxy)-3-bromoisopropoxybenzene3-Isopropoxy-1-bromobenzene3-bromo phenyl isopropyl ether3-bromo-i-propoxybenzene3-Bromophenylisopropylether1-bromo-3-isopropoxy-benzene
REACTIONS
相关反应
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