(S)-3-((tert-Butoxycarbonyl)amino)-2-(4-chlorophenyl)propanoic acid
- Product Name(S)-3-((tert-Butoxycarbonyl)amino)-2-(4-chlorophenyl)propanoic acid
- CAS116112-80-2
- MFC18H26O12
- MW434.39
- EINECS
- MOL File116112-80-2.mol
Chemical Properties
| Boiling point | 534.9±50.0 °C(Predicted) |
| Density | 1.32±0.1 g/cm3(Predicted) |
| pka | 4.61±0.10(Predicted) |
| InChI | InChI=1/C18H26O12/c1-9(19)26-8-13-15(27-10(2)20)16(28-11(3)21)17(29-12(4)22)18(30-13)25-7-5-6-14(23)24/h13,15-18H,5-8H2,1-4H3,(H,23,24)/t13-,15+,16+,17-,18-/s3 |
| InChIKey | YWFYYAPQJAVDIL-NGHDZHTCNA-N |
| SMILES | O([C@@H]1[C@H]([C@H](OCCCC(=O)O)O[C@H](COC(=O)C)[C@@H]1OC(=O)C)OC(=O)C)C(=O)C |&1:1,2,3,12,18,r| |
