uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09442321B2
查看IDENTITY
结构与身份
- 标准SMILES
- CCc1cc(CC)c2sc3ccccc3c(=O)c2c1
- InChIKey
- BTJPUDCSZVCXFQ-UHFFFAOYSA-N
- 分子式
- C17H16OS
- 平均分子量
- 268.4 g/mol
- 单同位素质量
- 268.0921863
COMPUTED
结构计算性质
- XLogP
- 5.1
- 极性表面积
- 42.4 Ų
- 氢键供体
- 0
- 氢键受体
- 2
- 可旋转键
- 2
- 重原子
- 19
- 形式电荷
- 0
- 复杂度
- 340
物化、安全与法规信息正在同步。
ALIASES
名称与别名
82799-44-82,4-DIETHYLTHIOXANTHONE9H-Thioxanthen-9-one, 2,4-diethyl-U5V0PD7FHZCHEMCURE DETXDETX-SEINECS 280-041-0UNII-U5V0PD7FHZDTXSID2072883RefChem:82414DTXCID7048320280-041-02,4-Diethyl-9H-thioxanthen-9-one2,4-Diethylthioxanthen-9-oneDETXC17H16OSMFCD000829102,4-diethyldibenzo[b,e]thiin-10-onediethylthioxanthenoneChlorprothixene Impurity 7
REACTIONS
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