HCID11205965

Methyl 2-amino-4-methylbenzoate

C9H11NO2165.19 g/molCAS 18595-17-0

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IDENTITY

结构与身份

标准SMILES: COC(=O)c1ccc(C)cc1N
InChIKey: VAQBJVZNPBNHGC-UHFFFAOYSA-N
分子式: C9H11NO2
平均分子量: 165.19 g/mol
单同位素质量: 165.07897859

COMPUTED

结构计算性质

已同步

XLogP: 2.2
极性表面积: 52.3 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 2
重原子: 12
形式电荷: 0
复杂度: 170

ALIASES

名称与别名

共 23 条

Methyl 2-amino-4-methylbenzoate18595-17-02-Amino-4-methylbenzoic acid methyl estermethyl 4-methylanthranilateMFCD09998260Methyl 2-amino-4-methyl-benzoatemethyl2-amino-4-methylbenzoateBenzoic acid, 2-amino-4-methyl-, methyl esterBoc-Pamb-OHSCHEMBL1129582DTXSID20458645VAQBJVZNPBNHGC-UHFFFAOYSA-NAR2393AKOS006302165DS-1251SB76096AC-28495SY0344732-Amino-4-methyl-benzoic acid methyl esterDB-011584

REACTIONS

参与反应

16 条

Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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

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

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uspto-grants-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07935694B2

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uspto-grants-2015_05 · 10.6084/m9.figshare.5104873.v1 · US09034887B2

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uspto-grants-2015_05 · 10.6084/m9.figshare.5104873.v1 · US09034887B2

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uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US05998653

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uspto-grants-2002_04 · 10.6084/m9.figshare.5104873.v1 · US06369270B1

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