505031-96-9
4-OXO-4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTER
Name4-OXO-4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTER
1Identification
【Name】
4-OXO-4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTER
【CAS】
【MDL】
MFCD18074086
【English Synonyms】
【Formula】
C9 H10 N2 O4
【MolWeight】
210.188
【Inchi】
InChI=1S/C9H10N2O4/c1-2-14-9(13)7-6-5(15-11-7)3-4-10-8(6)12/h2-4H2,1H3,(H,10,12)
【InChIKey】
InChIKey=FSCJLEKTUHYFQX-UHFFFAOYSA-N
【SMILES】
CCOC(=O)c1c2c(on1)CCNC2=O
【MOL File】
4-OXO-4,5,6,7-TETRAH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:1
H bond acceptor:6
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
4-OXO-4,5,6,7-TETRAHYDRO-ISOXAZOLO[4,5-C]PYRIDINE-3-CARBOXYLIC ACID ETHYL ESTER.cml