HCID736341

4-(Chloromethyl)-2-methyl-1,3-thiazole

C5H6ClNS147.63 g/molCAS 39238-07-8

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IDENTITY

结构与身份

标准SMILES: Cc1nc(CCl)cs1
InChIKey: AQBBZYVPKBIILN-UHFFFAOYSA-N
分子式: C5H6ClNS
平均分子量: 147.63 g/mol
单同位素质量: 146.9909481

COMPUTED

结构计算性质

等待补全

XLogP: 1.8
极性表面积: 41.1 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 1
重原子: 8
形式电荷: 0
复杂度: 78

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 33 条

4-(chloromethyl)-2-methyl-1,3-thiazoleRefChem:515595640-597-039238-07-84-(Chloromethyl)-2-methylthiazoleMFCD000516424-chloromethyl-2-methyl-1,3-thiazole2-methyl-4-chloromethylthiazole4-chloromethyl-2-methyl-thiazole2-methyl-4-chloromethyl-1,3-thiazolethiazole, 4-(chloromethyl)-2-methyl-Thiazole, 4-(chloromethyl)-2-methyl-, hydrochloride4-chloromethyl-2-methylthiazoleF2158-00402-Methyl-4-(chloromethyl)thiazole4-chlormethyl-2-methylthiazolSCHEMBL208648CHEMBL5194683DTXSID40353002SMSSF-0017668

REACTIONS

参与反应

115 条

uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07087602B2

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uspto-grants-1980_09 · 10.6084/m9.figshare.5104873.v1 · US04221584

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uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09440963B2

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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 (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 (9/10) · 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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