HCID84253

Methyl 3-aminobut-2-enoate

C5H9NO2115.13 g/molCAS 14205-39-1

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IDENTITY

结构与身份

标准 SMILES: COC(=O)C=C(C)N
InChIKey: XKORCTIIRYKLLG-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: 52.3 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 2
重原子: 8
形式电荷: 0
复杂度: 118

HAZARDS

危害信息

来源：PubChem

Regulatory Information

Chemical: 2-Butenoic acid, 3-amino-, methyl ester

2-Butenoic acid, 3-amino-, methyl ester: Does not have an individual approval but may be used under an appropriate group standard

REGULATORY

法规信息

来源：PubChem

Regulatory Information

Chemical: 2-Butenoic acid, 3-amino-, methyl ester

2-Butenoic acid, 3-amino-, methyl ester: Does not have an individual approval but may be used under an appropriate group standard

USES

用途与制造

来源：PubChem

General Manufacturing Information

2-Butenoic acid, 3-amino-, methyl ester: ACTIVE

ALIASES

名称与别名

共 14 条

14205-39-1methyl 3-aminobut-2-enoateMethyl 3-amino-2-butenoateNifedipine EP Impurity DSCHEMBL62213CHEMBL3560468SCHEMBL10559216MFCD00071534AKOS0252436533-amino-but-2-enoic acid methyl esterAB00926SY005584DB-042603Benidipine Impurity E; Nifedipine EP Impurity D

REACTIONS