1-[(benzyloxy)carbonyl]-4-ethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid
化学名:1-[(benzyloxy)carbonyl]-4-ethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid
CAS番号.1869118-25-1
英語名:1-[(benzyloxy)carbonyl]-4-ethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid
CBNumberCB54747852
MFC15H17NO4
MW275.3
MOL File1869118-25-1.mol
1-[(benzyloxy)carbonyl]-4-ethyl-2,5-dihydro-1H-pyrrole-3-carboxylic acid物理性質
沸点 | 452.3±45.0 °C(Predicted) |
比重(密度) | 1.267±0.06 g/cm3(Predicted) |
酸解離定数(Pka) | 4.28±0.20(Predicted) |
InChI | InChI=1S/C15H17NO4/c1-2-12-8-16(9-13(12)14(17)18)15(19)20-10-11-6-4-3-5-7-11/h3-7H,2,8-10H2,1H3,(H,17,18) |
InChIKey | HFBYGZWWAMZBID-UHFFFAOYSA-N |
SMILES | N1(C(OCC2=CC=CC=C2)=O)CC(CC)=C(C(O)=O)C1 |