5427-92-9
ETHYL 3-CYANO-6-METHYL-5-NITRO-2-OXO-1,2-DIHYDROPYRIDINE-4-CARBOXYLATE
NameETHYL 3-CYANO-6-METHYL-5-NITRO-2-OXO-1,2-DIHYDROPYRIDINE-4-CARBOXYLATE
1Identification
【Name】
ETHYL 3-CYANO-6-METHYL-5-NITRO-2-OXO-1,2-DIHYDROPYRIDINE-4-CARBOXYLATE
【CAS】
【MDL】
MFCD22377557
【English Synonyms】
【Formula】
C10 H9 N3 O5
【MolWeight】
251.197
【Inchi】
InChI=1S/C10H9N3O5/c1-3-18-10(15)7-6(4-11)9(14)12-5(2)8(7)13(16)17/h3H2,1-2H3,(H,12,14)
【InChIKey】
InChIKey=DAZOHUVXTFNNMV-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c(c(=O)[nH]c(c1[N+](=O)[O-])C)C#N
【MOL File】
ETHYL 3-CYANO-6-METH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:FB
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 3-CYANO-6-METHYL-5-NITRO-2-OXO-1,2-DIHYDROPYRIDINE-4-CARBOXYLATE.cml