Vitas-M small molecule compound
6-chloro-7-[2,6-dinitro-4-(trifluoromethyl)phenoxy]-4-phenyl-2H-chromen-2-one
Catalog ID
STK716666
SMILES O=c1oc2cc(Oc3c(cc(cc3[N+](=O)[O-])C(F)(F)F)[N+](=O)[O-])c(cc2c(c1)c1ccccc1)Cl
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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 C22H10ClF3N2O7 MW 506.78 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H10ClF3N2O7/c23-15-8-14-13(11-4-2-1-3-5-11)9-20(29)34-18(14)10-19(15)35-21-16(27(30)31)6-12(22(24,25)26)7-17(21)28(32)33/h1-10HInChIKey
SHWKRHUPNIBWRW-UHFFFAOYSA-NSynonyms
314743-14-1314743141
6chloro7(26dinitro4(trifluoromethyl)phenoxy)4phenyl2Hchromen2one
6CHLORO7(26DINITRO4(TRIFLUOROMETHYL)PHENOXY)4PHENYLCHROMEN2ONE
C1=CC=C(C=C1)C2=CC(=O)OC3=CC(=C(C=C23)Cl)OC4=C(C=C(C=C4(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC22H10ClF3N2O7c231581413(114213511)920(29)3418(14)1019(15)352116(27(30)31)612(22(2425)26)717(21)28(32)33h110H
MFCD00791675
O=c1oc2cc(Oc3c(cc(cc3(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O))c(cc2c(c1)c1ccccc1)Cl
ZINC000001762039
ZINC01762039
ZINC1762039
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