(1,8,8-TRIMETHYL-2,4-DIOXO-3-AZA-BICYCLO[3.2.1]-OCT-3-YL)-ACETIC ACID
英文名称:(1,8,8-Trimethyl-2,4-dioxo-3-aza-bicyclo[3.2.1]-oct-3-yl)-acetic acid
CAS号:1212-95-9
分子式:C12H17NO4
分子量:239.27
EINECS号:
Mol文件:Mol File
(1,8,8-TRIMETHYL-2,4-DIOXO-3-AZA-BICYCLO[3.2.1]-OCT-3-YL)-ACETIC ACID 性质
| 熔点 | 169 °C |
|---|---|
| 沸点 | 431.2±28.0 °C(Predicted) |
| 密度 | 1.243±0.06 g/cm3(Predicted) |
| 酸度系数(pKa) | 3.74±0.10(Predicted) |
| 形态 | solid |
| InChI | 1S/C12H17NO4/c1-11(2)7-4-5-12(11,3)10(17)13(9(7)16)6-8(14)15/h7H,4-6H2,1-3H3,(H,14,15)/t7-,12+/m0/s1 |
| InChIKey | LBMVFGRSRGURMJ-JVXZTZIISA-N |
| SMILES | C[C@@]1(CC[C@](C2=O)([H])C(C)1C)C(N2CC(O)=O)=O |