105301-23-3
2,2'-(2-QUINOXALINYLMETHYLENE)BIS(3-ETHYL-4-METHOXYPHENOL) N,N'-DIOXIDE
Name2,2'-(2-QUINOXALINYLMETHYLENE)BIS(3-ETHYL-4-METHOXYPHENOL) N,N'-DIOXIDE
1Identification
【Name】
2,2'-(2-QUINOXALINYLMETHYLENE)BIS(3-ETHYL-4-METHOXYPHENOL) N,N'-DIOXIDE
【CAS】
【MDL】
MFCD01766339
【English Synonyms】
【Formula】
C27 H28 N2 O6
【MolWeight】
476.526
【Inchi】
InChI=1S/C27H28N2O6/c1-5-16-23(34-3)13-11-21(30)25(16)27(26-17(6-2)24(35-4)14-12-22(26)31)20-15-28(32)18-9-7-8-10-19(18)29(20)33/h7-15,27,30-31H,5-6H2,1-4H3
【InChIKey】
InChIKey=BKWMECGMCYRRQP-UHFFFAOYSA-N
【SMILES】
CCc1c(ccc(c1C(c2c[n+](c3ccccc3[n+]2[O-])[O-])c4c(ccc(c4CC)OC)O)O)OC
【MOL File】
2,2'-(2-QUINOXALINYL….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:2
H bond acceptor:8
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
2,2'-(2-QUINOXALINYLMETHYLENE)BIS(3-ETHYL-4-METHOXYPHENOL) N,N'-DIOXIDE.cml