137987-90-7
ETHANONE, 1-(2,4-DIHYDROXYPHENYL)-2-(3-NITROPHENOXY)-
NameETHANONE, 1-(2,4-DIHYDROXYPHENYL)-2-(3-NITROPHENOXY)-
1Identification
【Name】
ETHANONE, 1-(2,4-DIHYDROXYPHENYL)-2-(3-NITROPHENOXY)-
【CAS】
【MDL】
MFCD00525518
【English Synonyms】
【Formula】
C14 H11 N O6
【MolWeight】
289.242
【Inchi】
InChI=1S/C14H11NO6/c16-10-4-5-12(13(17)7-10)14(18)8-21-11-3-1-2-9(6-11)15(19)20/h1-7,16-17H,8H2
【InChIKey】
InChIKey=CXNRFGUEAKKRFT-UHFFFAOYSA-N
【SMILES】
c1cc(cc(c1)OCC(=O)c2ccc(cc2O)O)[N+](=O)[O-]
【MOL File】
ETHANONE, 1-(2,4-DIH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
ETHANONE, 1-(2,4-DIHYDROXYPHENYL)-2-(3-NITROPHENOXY)-.cml