HCID86887

tert-Butyl 2,4,5-trichlorophenyl carbonate

tert-butyl (2,4,5-trichlorophenyl) carbonate

C11H11Cl3O3297.6 g/molCAS 16965-08-5

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)OC(=O)Oc1cc(Cl)c(Cl)cc1Cl
InChIKey: LJFPGBIHDPZHIN-UHFFFAOYSA-N
分子式: C11H11Cl3O3
平均分子量: 297.6 g/mol
单同位素质量: 295.977377

COMPUTED

结构计算性质

等待补全

XLogP: 4.9
极性表面积: 35.5 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 4
重原子: 17
形式电荷: 0
复杂度: 278

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 29 条

16965-08-5tert-Butyl 2,4,5-trichlorophenyl carbonateCarbonic acid, 1,1-dimethylethyl 2,4,5-trichlorophenyl esterH3JB4NV3SVEINECS 241-039-5DTXSID70661401,1-DIMETHYLETHYL 2,4,5-TRICHLOROPHENYL CARBONATECARBONIC ACID, TERT-BUTYL 2,4,5-TRICHLOROPHENYL ESTERRefChem:892173DTXCID2035431241-039-5tert-butyl (2,4,5-trichlorophenyl) carbonateCarbonic Acid tert-Butyl 2,4,5-Trichlorophenyl Estert-Butyl 2,4,5-trichlorophenyl carbonate2,4,5-trichlorophenyl (tert-butoxy)formatet-butyl 2,4,5-trichlorophenylcarbonateUNII-H3JB4NV3SV1-(tert-Butoxycarbonyloxy)-2,4,5-trichlorobenzeneSCHEMBL1984953SCHEMBL30739992

REACTIONS

参与反应

5 条

uspto-grants-1981_03 · 10.6084/m9.figshare.5104873.v1 · US04254273

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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uspto-grants-1976_11 · 10.6084/m9.figshare.5104873.v1 · US03991205

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uspto-grants-1976_11 · 10.6084/m9.figshare.5104873.v1 · US03991205

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