Vitas-M small molecule compound
1,1'-(2,2,2-trichloroethane-1,1-diyl)bis(4-ethoxy-3,5-dinitrobenzene)
Catalog ID
STK671505
SMILES CCOc1c(cc(cc1[N+](=O)[O-])C(C(Cl)(Cl)Cl)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])OCC)[N+](=O)[O-]
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C18H15Cl3N4O10 MW 553.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15Cl3N4O10/c1-3-34-16-11(22(26)27)5-9(6-12(16)23(28)29)15(18(19,20)21)10-7-13(24(30)31)17(35-4-2)14(8-10)25(32)33/h5-8,15H,3-4H2,1-2H3InChIKey
PZGVFMGFBVSVFJ-UHFFFAOYSA-NSynonyms
11(222TRICHLOROETHANE11DIYL)BIS(4ETHOXY35DINITROBENZENE)
2ETHOXY13DINITRO5(222TRICHLORO1(4ETHOXY35DINITROPHENYL)ETHYL)BENZENE
CCOC1=C(C=C(C=C1(N+)(=O)(O))C(C2=CC(=C(C(=C2)(N+)(=O)(O))OCC)(N+)(=O)(O))C(Cl)(Cl)Cl)(N+)(=O)(O)
CCOc1c(cc(cc1(N+)(=O)(O))C(C(Cl)(Cl)Cl)c1cc((N+)(=O)(O))c(c(c1)(N+)(=O)(O))OCC)(N+)(=O)(O)
InChI=1SC18H15Cl3N4O10c13341611(22(26)27)59(612(16)23(28)29)15(18(1920)21)10713(24(30)31)17(3542)14(810)25(32)33h5815H34H212H3
MFCD00625767
ZINC000100045168
ZINC100045168
Check stock
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Check stock on Vitas-MAvailable files
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