534571-77-2
ETHYL 6-(HYDROXYMETHYL)-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE-2-CARBOXYLATE
NameETHYL 6-(HYDROXYMETHYL)-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE-2-CARBOXYLATE
1Identification
【Name】
ETHYL 6-(HYDROXYMETHYL)-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE-2-CARBOXYLATE
【CAS】
【MDL】
MFCD12911968
【English Synonyms】
【Formula】
C12 H15 N O4
【MolWeight】
237.253
【Inchi】
InChI=1S/C12H15NO4/c1-2-16-12(15)11-6-13-9-5-8(7-14)3-4-10(9)17-11/h3-5,11,13-14H,2,6-7H2,1H3
【InChIKey】
InChIKey=DJFXGRUOBREKLG-UHFFFAOYSA-N
【SMILES】
CCOC(=O)C1CNc2cc(ccc2O1)CO
【MOL File】
ETHYL 6-(HYDROXYMETH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:5
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHYL 6-(HYDROXYMETHYL)-3,4-DIHYDRO-2H-BENZO[B][1,4]OXAZINE-2-CARBOXYLATE.cml