HCID10285998

Tert-butyl 2-oxo-2-pyrimidin-2-ylethyl(methyl)carbamate

tert-butyl N-methyl-N-(2-oxo-2-pyrimidin-2-ylethyl)carbamate

C12H17N3O3251.28 g/mol

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IDENTITY

结构与身份

标准SMILES: CN(CC(=O)c1ncccn1)C(=O)OC(C)(C)C
InChIKey: OUXCTKJXMIRFBS-UHFFFAOYSA-N
分子式: C12H17N3O3
平均分子量: 251.28 g/mol
单同位素质量: 251.12699141

COMPUTED

结构计算性质

已同步

XLogP: 1.1
极性表面积: 72.4 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 5
重原子: 18
形式电荷: 0
复杂度: 306

ALIASES

名称与别名

共 7 条

SCHEMBL6284338OUXCTKJXMIRFBS-UHFFFAOYSA-NDB-198717tert-butyl 2-oxo-2-pyrimidin-2-ylethyl(methyl)carbamatetert-Butyl (1-(pyrimidin-2-yl)ethanon-2-yl)(methyl)carbamateMethyl[2-oxo-2-(2-pyrimidinyl)ethyl]carbamic acid 1,1-dimethylethyl ester562101-42-2

REACTIONS

参与反应

4 条

uspto-grants-2005_02 · 10.6084/m9.figshare.5104873.v1 · US06852731B2

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uspto-grants-2005_02 · 10.6084/m9.figshare.5104873.v1 · US06852731B2

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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