HCID10988578

4-(1-Methoxycarbonyl-but-3-ynyl)

methyl 4-(1-methoxy-1-oxopent-4-yn-2-yl)benzoate

C14H14O4246.26 g/molCAS 146464-90-6

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IDENTITY

结构与身份

标准SMILES: C#CCC(C(=O)OC)c1ccc(C(=O)OC)cc1
InChIKey: WPUHVBXXNXFUJZ-UHFFFAOYSA-N
分子式: C14H14O4
平均分子量: 246.26 g/mol
单同位素质量: 246.08920892

COMPUTED

结构计算性质

等待补全

XLogP: 2.2
极性表面积: 52.6 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 6
重原子: 18
形式电荷: 0
复杂度: 344

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 26 条

146464-90-64-(1-Methoxycarbonyl-but-3-ynyl)RefChem:510325695-816-2methyl 4-(1-methoxy-1-oxopent-4-yn-2-yl)benzoatealpha-Propargylhomoterephthalic Acid Dimethyl EsterMethyl 4-(1-methoxy-1-oxo-4-pentyn-2-yl)benzoateMFCD18071581BENZENEACETIC ACID, 4-(METHOXYCARBONYL)-ALPHA-2-PROPYN-1-YL-, METHYL ESTERKMJ3AM9EBMa-propargylhomoterephthalic acid dimethyl ester|A-propargylhomoterephthalic acid dimethyl esterMethyl 4-(1-methoxycarbonylbut-3-ynyl)benzoateSCHEMBL15075286WPUHVBXXNXFUJZ-UHFFFAOYSA-NCS-M1825AKOS015916962Benzeneacetic acid, 4-(methoxycarbonyl)-?-2-propyn-1-yl-, methyl esterCS-14076Dimethyl alpha-propargyl homoterephthalate

REACTIONS