74632-03-4
DIETHYL 4-OXO-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE
NameDIETHYL 4-OXO-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE
1Identification
【Name】
DIETHYL 4-OXO-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE
【CAS】
【MDL】
MFCD12025854
【English Synonyms】
【Formula】
C11 H13 N O5
【MolWeight】
239.226
【Inchi】
InChI=1S/C11H13NO5/c1-3-16-10(14)7-5-12-6-8(9(7)13)11(15)17-4-2/h5-6H,3-4H2,1-2H3,(H,12,13)
【InChIKey】
InChIKey=GGMYLXLRJKRWQM-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c[nH]cc(c1=O)C(=O)OCC
【MOL File】
DIETHYL 4-OXO-1,4-DI….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
DIETHYL 4-OXO-1,4-DIHYDRO-3,5-PYRIDINEDICARBOXYLATE.cml