959408-49-2
DIMETHYL 10-OXO-1-PHENYL-1,10-DIHYDRO-2H-9-OXA-1-AZAANTHRACENE-2,3-DICARBOXYLATE
NameDIMETHYL 10-OXO-1-PHENYL-1,10-DIHYDRO-2H-9-OXA-1-AZAANTHRACENE-2,3-DICARBOXYLATE
1Identification
【Name】
DIMETHYL 10-OXO-1-PHENYL-1,10-DIHYDRO-2H-9-OXA-1-AZAANTHRACENE-2,3-DICARBOXYLATE
【CAS】
【MDL】
MFCD11707066
【English Synonyms】
【Formula】
C22 H17 N O6
【MolWeight】
391.377
【Inchi】
InChI=1S/C22H17NO6/c1-27-21(25)15-12-16-19(24)14-10-6-7-11-17(14)29-20(16)23(18(15)22(26)28-2)13-8-4-3-5-9-13/h3-12,18H,1-2H3
【InChIKey】
InChIKey=MZHNOLWHEPGSOE-UHFFFAOYSA-N
【SMILES】
COC(=O)C1C(=Cc2c(=O)c3ccccc3oc2N1c4ccccc4)C(=O)OC
【MOL File】
DIMETHYL 10-OXO-1-PH….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:7
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
DIMETHYL 10-OXO-1-PHENYL-1,10-DIHYDRO-2H-9-OXA-1-AZAANTHRACENE-2,3-DICARBOXYLATE.cml