2655727-42-5 ((1,4-Piperazinedicarboxylic acid, 2-(cyanomethyl)-, 4-(1,1-dimethylethyl) 1-(phenylmethyl) ester, (2R)-)

CAS号:
2655727-42-5
英文名称:
1,4-Piperazinedicarboxylic acid, 2-(cyanomethyl)-, 4-(1,1-dimethylethyl) 1-(phenylmethyl) ester, (2R)-
分子式:
C19H25N3O4
分子量:
359.419504880905

1,4-Piperazinedicarboxylic acid, 2-(cyanomethyl)-, 4-(1,1-dimethylethyl) 1-(phenylmethyl) ester, (2R)-(2655727-42-5)名称与标识符

名称

英文别名:
1,4-Piperazinedicarboxylic acid, 2-(cyanomethyl)-, 4-(1,1-dimethylethyl) 1-(phenylmethyl) ester, (2R)-;(R)-1-Cbz-4-Boc-2-(cyanomethyl)piperazine;

标识符

InChIKey:
DQFHYQNTXCMXJL-MRXNPFEDSA-N
Inchi:
1S/C19H25N3O4/c1-19(2,3)26-17(23)21-11-12-22(16(13-21)9-10-20)18(24)25-14-15-7-5-4-6-8-15/h4-8,16H,9,11-14H2,1-3H3/t16-/m1/s1
SMILES:
N1(C(OCC2=CC=CC=C2)=O)CCN(C(OC(C)(C)C)=O)C[C@H]1CC#N

1,4-Piperazinedicarboxylic acid, 2-(cyanomethyl)-, 4-(1,1-dimethylethyl) 1-(phenylmethyl) ester, (2R)-(2655727-42-5)物化性质

实验特性

  • 沸点 : 510.2±35.0 °C(Predicted)
  • 酸度系数(pKa) : -1.04±0.70(Predicted)
  • 密度 : 1.178±0.06 g/cm3(Predicted)