HCID70953

3-Methyl-5-(trichloromethyl)-1,2,4-oxadiazole

C4H3Cl3N2O201.43 g/molCAS 1195-25-1

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IDENTITY

结构与身份

标准SMILES: Cc1noc(C(Cl)(Cl)Cl)n1
InChIKey: ZHFWJCUKKDMFIV-UHFFFAOYSA-N
分子式: C4H3Cl3N2O
平均分子量: 201.43 g/mol
单同位素质量: 199.931096

COMPUTED

结构计算性质

等待补全

XLogP: 2.2
极性表面积: 38.9 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 0
重原子: 10
形式电荷: 0
复杂度: 126

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 28 条

3-Methyl-5-(trichloromethyl)-1,2,4-oxadiazole1,2,4-Oxadiazole, 3-methyl-5-(trichloromethyl)-UNII-L7644EE165L7644EE165DTXSID9073254RefChem:94790DTXCID9033507825-544-31195-25-1MFCD019382993-Methyl-5-trichloromethyl-1,2,4-oxadiazole3-methyl-5-trichloromethyl-[1,2,4]oxadiazoleC4H3Cl3N2OSCHEMBL145347SCHEMBL27343664ZHFWJCUKKDMFIV-UHFFFAOYSA-NBAA19525AKOS022182871CS-12359SY047555

REACTIONS

参与反应

7 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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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 (6/10) · 10.1039/C8SC04228D

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uspto-grants-1979_07 · 10.6084/m9.figshare.5104873.v1 · US04163048

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uspto-grants-1999_03 · 10.6084/m9.figshare.5104873.v1 · US05883102

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uspto-grants-1979_09 · 10.6084/m9.figshare.5104873.v1 · US04166818

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uspto-grants-1995_12 · 10.6084/m9.figshare.5104873.v1 · US05478939

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