HCID90693494

Racemic methyl-3-azido-2-hydroxy-1-methyl-cyclohexane-carboxylate

methyl 3-azido-2-hydroxy-1-methylcyclohexane-1-carboxylate

C9H15N3O3213.23 g/mol

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IDENTITY

结构与身份

标准SMILES: COC(=O)C1(C)CCCC(N=[N+]=[N-])C1O
InChIKey: WDQXMPDGZHIUNJ-UHFFFAOYSA-N
分子式: C9H15N3O3
平均分子量: 213.23 g/mol
单同位素质量: 213.11134135

COMPUTED

结构计算性质

已同步

XLogP: 2.2
极性表面积: 60.9 Å²
氢键供体: 1
氢键受体: 5
可旋转键: 3
重原子: 15
形式电荷: 0
复杂度: 301

ALIASES

名称与别名

共 4 条

SCHEMBL20394635WDQXMPDGZHIUNJ-UHFFFAOYSA-Nracemic methyl-3-azido-2-hydroxy-1-methyl-cyclohexane-carboxylateracemic methyl-3-azido-2-hydroxy-1-methyl-cyclohexanecarboxylate

REACTIONS

参与反应

4 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08829007B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08829007B2

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09345708B2

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uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09345708B2

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