Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate
化学名:Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate
CAS番号.2158302-01-1
英語名:Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate
CBNumberCB84800866
MFC14H17N3O2
MW259.3
MOL File2158302-01-1.mol
Benzyl (S)-2-(cyanomethyl)piperazine-1-carboxylate物理性質
| 沸点 | 450.9±30.0 °C(Predicted) |
| 比重(密度) | 1.163±0.06 g/cm3(Predicted) |
| 酸解離定数(Pka) | 7.69±0.40(Predicted) |
| InChI | InChI=1S/C14H17N3O2/c15-7-6-13-10-16-8-9-17(13)14(18)19-11-12-4-2-1-3-5-12/h1-5,13,16H,6,8-11H2/t13-/m0/s1 |
| InChIKey | QSKMFYCQRQLYMF-ZDUSSCGKSA-N |
| SMILES | N1(C(OCC2=CC=CC=C2)=O)CCNC[C@@H]1CC#N |
