uspto-grants-1995_06 · 10.6084/m9.figshare.5104873.v1 · US05428052
查看IDENTITY
结构与身份
- 标准SMILES
- CC1(C)CCC(C)(C)c2cc(C(=O)Cl)ccc21
- InChIKey
- CPWIUCQCJRWWTH-UHFFFAOYSA-N
- 分子式
- C15H19ClO
- 平均分子量
- 250.76 g/mol
- 单同位素质量
- 250.1124429
COMPUTED
结构计算性质
- XLogP
- 5.6
- 极性表面积
- 17.1 Ų
- 氢键供体
- 0
- 氢键受体
- 1
- 可旋转键
- 1
- 重原子
- 17
- 形式电荷
- 0
- 复杂度
- 319
物化、安全与法规信息正在同步。
ALIASES
名称与别名
104224-50-25,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbonyl chloride5,5,8,8-TETRAMETHYL-5,6,7,8-TETRAHYDRO-2-NAPHTHALENECARBONYL CHLORIDE5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonyl chlorideCPWIUCQCJRWWTH-UHFFFAOYSA-N2-Naphthalenecarbonylchloride, 5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-SCHEMBL1022234DTXSID00383688MFCD04115383BP-10067DB-0591135,5,8,8-tetramethyl-5,6,7,8-tetrahydro-2-naphthoyl chloride5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphthoyl chloride5,6,7,8-tetrahydro-5,5,8,8-tetramethyl-2-naphtoyl chloride5,6,7,8-tetrahydro-5,5,8,8-tetramethyl -2-naphthoyl chloride5,6,7,8-tetrahydro-5,5,8,8-tetramethyl- 2-naphthoyl chloride5, 6, 7, 8-tetrahydro-5, 5, 8, 8-tetramethyl-2-naphtoyl chloride5,5,8,8-tetramethyl-5,6,7,8-tetra hydronaphthalene-2-carbonyl chloride5,5,8,8-tetramethyl-5,6,7,8-tetrahydronaphthalene-2-carbonylchloride5,6,7, 8-tetrahydro-5,5,8,8-tetramethylnaphthalene-2-carbonyl chloride
REACTIONS
相关反应
Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D
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