HCID324458

2-Bromo-N-(5-nitro-thiazol-2-yl)-acetamide

2-bromo-N-(5-nitro-1,3-thiazol-2-yl)acetamide

C5H4BrN3O3S266.08 g/molCAS 349121-09-1

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IDENTITY

结构与身份

标准SMILES: O=C(CBr)Nc1ncc([N+](=O)[O-])s1
InChIKey: BRKREXOHFNPWGB-UHFFFAOYSA-N
分子式: C5H4BrN3O3S
平均分子量: 266.08 g/mol
单同位素质量: 264.91567

COMPUTED

结构计算性质

已同步

XLogP: 2.1
极性表面积: 116 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 2
重原子: 13
形式电荷: 0
复杂度: 222

ALIASES

名称与别名

共 13 条

349121-09-12-Bromo-N-(5-nitro-thiazol-2-yl)-acetamideDTXSID60314933RefChem:257584DTXCID302660562-Bromo-N-(5-nitrothiazol-2-yl)acetamide2-bromo-N-(5-nitro-1,3-thiazol-2-yl)acetamideNSC289929SCHEMBL3466003BRKREXOHFNPWGB-UHFFFAOYSA-NAKOS012990232NSC-2899292-bromo-N-(5-nitrothiazole-2-yl)acetamide

REACTIONS

参与反应

2 条

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

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uspto-grants-2010_03 · 10.6084/m9.figshare.5104873.v1 · US07678791B2

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