HCID11007867

4-Methylmorpholin-3-one

C5H9NO2115.13 g/molCAS 20721-78-2

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IDENTITY

结构与身份

标准SMILES: CN1CCOCC1=O
InChIKey: FGQBGDBLZZPFCM-UHFFFAOYSA-N
分子式: C5H9NO2
平均分子量: 115.13 g/mol
单同位素质量: 115.06332853

COMPUTED

结构计算性质

已同步

XLogP: -0.6
极性表面积: 29.5 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 0
重原子: 8
形式电荷: 0
复杂度: 103

ALIASES

名称与别名

共 21 条

4-methylmorpholin-3-one20721-78-24-Methyl-morpholin-3-one3-Morpholinone, 4-methyl-MFCD172927684-methyl-3-morpholinone4-methyltetrahydro-1,4-oxazin-3-oneSCHEMBL428490SCHEMBL1564364SCHEMBL1805763SCHEMBL16498365DTXSID40451557FGQBGDBLZZPFCM-UHFFFAOYSA-NAKOS015996227SB22860BS-22028DA-20371SY024762CS-0145226E81830

REACTIONS

参与反应

2 条

uspto-grants-1980_11 · 10.6084/m9.figshare.5104873.v1 · US04235902

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uspto-grants-1981_12 · 10.6084/m9.figshare.5104873.v1 · US04303788

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