基本信息
- 标准SMILES
CC1(C)CCCc2cc(B(O)O)ccc21- InChIKey
ICEYITRJZFKDPU-UHFFFAOYSA-N- 分子式
- C12H17BO2
- 平均分子量
- 204.08 g/mol
名称与标识
- 首选名称
- (5,6,7,8-Tetrahydro-5,5-dimethylnaphth-2-yl)boronic acid
- IUPAC
- (5,5-dimethyl-7,8-dihydro-6H-naphthalen-2-yl)boronic acid
名称与别名
201141-66-4(5,5-Dimethyl-5,6,7,8-tetrahydronaphthalen-2-yl)boronic acid(5,6,7,8-tetrahydro-5,5-dimethylnaphth-2-yl)boronic acidSCHEMBL6293921ICEYITRJZFKDPU-UHFFFAOYSA-N(5,6,7,8-tetrahydro-5,5dimethylnaphth-2-yl)boronic acid(5,6,7,8tetrahydro-5,5-dimethylnaphth-2-yl)boronic acid(5,6,7.8-Tetrahydro-5,5-dimethylnaphth-2-yl)boronic acid(5,6,7,8-tetrahydro-5,5 -dimethylnaphth-2-yl)boronic acid(5,6,7,8-tetrahydro-5,5-dimethylnaphth -2-yl)boronic acid(5,6,7,8-tetrahydro-5,5-dimethylnaphth-2-yl) boronic acid
数据库标识
- PubChem CID
- 22571498
性质
结构计算性质
- 极性表面积
- 40.5 Ų
- 氢键供体
- 2
- 氢键受体
- 2
- 可旋转键
- 1
- 重原子
- 15
- 形式电荷
- 0
- 复杂度
- 228
相关反应
32 条
关联笔记
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