HCID57942605

Tert-butyl 8-formyl-2,3-dihydro-4H-benzo[B][1,4]oxazine-4-carboxylate

tert-butyl 8-formyl-2,3-dihydro-1,4-benzoxazine-4-carboxylate

C14H17NO4263.29 g/mol

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)OC(=O)N1CCOc2c(C=O)cccc21
InChIKey: IFJDTOVJJKYSSI-UHFFFAOYSA-N
分子式: C14H17NO4
平均分子量: 263.29 g/mol
单同位素质量: 263.11575802

COMPUTED

结构计算性质

已同步

XLogP: 1.9
极性表面积: 55.8 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 3
重原子: 19
形式电荷: 0
复杂度: 350

ALIASES

名称与别名

共 8 条

TERT-BUTYL 8-FORMYL-2,3-DIHYDRO-4H-BENZO[B][1,4]OXAZINE-4-CARBOXYLATE189293-44-5SCHEMBL306243SCHEMBL29753309IFJDTOVJJKYSSI-UHFFFAOYSA-NAT31972F8508928-formyl-2,3-dihydro-benzo[1,4]oxazine-4-carboxylic acid tert-butyl ester

REACTIONS

参与反应

8 条

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-2012_01 · 10.6084/m9.figshare.5104873.v1 · US08093247B2

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uspto-grants-2012_01 · 10.6084/m9.figshare.5104873.v1 · US08093247B2

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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uspto-grants-2009_11 · 10.6084/m9.figshare.5104873.v1 · US07622583B2

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uspto-grants-2009_11 · 10.6084/m9.figshare.5104873.v1 · US07622583B2

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uspto-grants-2013_08 · 10.6084/m9.figshare.5104873.v1 · US08519135B2

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uspto-grants-2013_08 · 10.6084/m9.figshare.5104873.v1 · US08519135B2

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