96449-64-8
中文名称
1-(3,4-二甲氧基苄基)-5-氧代吡咯烷-3-羧酸
英文名称
1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid
CAS
96449-64-8
分子式
C14H17NO5
分子量
279.29
MOL 文件
96449-64-8.mol
结构式
基本信息
中文别名
1-(3,4-二甲氧基苄基)-5-氧代吡咯烷-3-羧酸
英文别名
1-(3,4-Dimethoxybenzyl)pyrrolidin-5-one-3-carboxylic acid
1-(3,4-Dimethoxybenzyl)-5-oxo-3-pyrrolidinecarboxylic acid
1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid
1-[(3,4-dimethoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid
3-Pyrrolidinecarboxylic acid, 1-[(3,4-dimethoxyphenyl)methyl]-5-oxo-
1-(3,4-Dimethoxybenzyl)-5-oxo-3-pyrrolidinecarboxylic acid
1-(3,4-Dimethoxy-benzyl)-5-oxo-pyrrolidine-3-carboxylic acid
1-[(3,4-dimethoxyphenyl)methyl]-5-oxopyrrolidine-3-carboxylic acid
3-Pyrrolidinecarboxylic acid, 1-[(3,4-dimethoxyphenyl)methyl]-5-oxo-
物理化学性质
| 沸点 | 517.8±50.0 °C(Predicted) |
| 密度 | 1.300±0.06 g/cm3(Predicted) |
| 酸度系数(pKa) | 4.48±0.20(Predicted) |
| 形态 | solid |
| InChI | 1S/C14H17NO5/c1-19-11-4-3-9(5-12(11)20-2)7-15-8-10(14(17)18)6-13(15)16/h3-5,10H,6-8H2,1-2H3,(H,17,18) |
| InChIKey | LAGVWNLMHYIYJP-UHFFFAOYSA-N |
| SMILES | N2(CC(CC2=O)C(=O)O)Cc1cc(c(cc1)OC)OC |
安全数据
| WGK Germany | WGK 3 |
| 危险等级 | IRRITANT |
| 海关编码 | 2933998090 |
| 存储类别 | 11 - Combustible Solids |