HCID121015

Ethyl 3-(N,N-dimethylamino)acrylate

ethyl 3-(dimethylamino)prop-2-enoate

C7H13NO2143.18 g/molCAS 924-99-2

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)C=CN(C)C
InChIKey: MVUMJYQUKKUOHO-UHFFFAOYSA-N
分子式: C7H13NO2
平均分子量: 143.18 g/mol
单同位素质量: 143.09462866

COMPUTED

结构计算性质

已同步

XLogP: 0.8
极性表面积: 29.5 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 4
重原子: 10
形式电荷: 0
复杂度: 130

ALIASES

名称与别名

共 27 条

924-99-2Ethyl 3-(N,N-dimethylamino)acrylateethyl 3-(dimethylamino)prop-2-enoateMoxifloxacin Impurity 71ethyl 3-dimethylaminoacrylateSCHEMBL286112ethyl 3-dimethylamino-acrylateethyl beta-dimethylaminoacrylateSCHEMBL6247094SCHEMBL6247097ethyl-3-(dimethylamino)acrylateethyl dimethylaminomethylenacetateMVUMJYQUKKUOHO-UHFFFAOYSA-NDTXSID001380390ethyl-3-dimethylamino-2-propenoateSTR01169ethyl 3-(dimethylamino)-2-propenoateethyl-3-(dimethylamino)-2-propenoatePB39607ethyl 3-(N,N-dimethyl-amino) acrylate

REACTIONS

参与反应

79 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

uspto-grants-2010_06

作为反应物

HRID 12875 方程式

uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07728029B2

uspto-grants-2014_09

作为反应物

HRID 83422 方程式

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846719B2

uspto-grants-2014_09

作为反应物

HRID 83451 方程式

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846719B2

uspto-grants-2014_09

作为反应物

HRID 83463 方程式

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846719B2

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为反应物

HRID 98317 方程式

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

Training data from https://doi.org/10.1039/C8SC04228D (9/10)

作为反应物

HRID 144720 方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

Training data from https://doi.org/10.1039/C8SC04228D (9/10)

作为反应物

HRID 154584 方程式

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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

作为反应物

HRID 195656 方程式

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