502135-05-9
ETHYL 3-METHYL-7-OXO-6,7-DIHYDROISOXAZOLO[3,4-D]PYRIDAZINE-4-CARBOXYLATE
NameETHYL 3-METHYL-7-OXO-6,7-DIHYDROISOXAZOLO[3,4-D]PYRIDAZINE-4-CARBOXYLATE
1Identification
【Name】
ETHYL 3-METHYL-7-OXO-6,7-DIHYDROISOXAZOLO[3,4-D]PYRIDAZINE-4-CARBOXYLATE
【CAS】
【MDL】
MFCD12911967
【English Synonyms】
【Formula】
C9 H9 N3 O4
【MolWeight】
223.187
【Inchi】
InChI=1S/C9H9N3O4/c1-3-15-9(14)7-5-4(2)16-12-6(5)8(13)11-10-7/h3H2,1-2H3,(H,11,13)
【InChIKey】
InChIKey=YHMIUDWVIYZRCQ-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c2c(onc2c(=O)[nH]n1)C
【MOL File】
ETHYL 3-METHYL-7-OXO….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:7
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 3-METHYL-7-OXO-6,7-DIHYDROISOXAZOLO[3,4-D]PYRIDAZINE-4-CARBOXYLATE.cml