![[3S-[2(R*),3α,8aβ]]-Hexahydro-3-Methyl-1,4-dioxo-α-(2-phenylethyl)pyrrolo[1,2-a]pyrazine-2(1H)-acetic Acid Structure](/CAS/GIF/115623-21-7.gif)
[3S-[2(R*),3α,8aβ]]-Hexahydro-3-Methyl-1,4-dioxo-α-(2-phenylethyl)pyrrolo[1,2-a]pyrazine-2(1H)-acetic Acid
- Product Name[3S-[2(R*),3α,8aβ]]-Hexahydro-3-Methyl-1,4-dioxo-α-(2-phenylethyl)pyrrolo[1,2-a]pyrazine-2(1H)-acetic Acid
- CAS115623-21-7
- MFC18H22N2O4
- MW330.38
- EINECS
- MOL File115623-21-7.mol
Chemical Properties
| Boiling point | 595.7±50.0 °C(Predicted) |
| Density | 1.31±0.1 g/cm3(Predicted) |
| pka | 3.56±0.10(Predicted) |
| InChI | InChI=1/C18H22N2O4/c1-12-16(21)19-11-5-8-14(19)17(22)20(12)15(18(23)24)10-9-13-6-3-2-4-7-13/h2-4,6-7,12,14-15H,5,8-11H2,1H3,(H,23,24)/t12-,14-,15-/s3 |
| InChIKey | PDBULCBUWNSQTL-CBQDEAQBNA-N |
| SMILES | N1([C@@H](C)C(=O)N2[C@H](C1=O)CCC2)[C@H](C(=O)O)CCc1ccccc1 |&1:1,6,12,r| |
