Vitas-M small molecule compound
1-{4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}ethanone
Catalog ID
STK150185
SMILES CC(=O)N1CCN(CC1)c1c(cc(cc1[N+](=O)[O-])C(F)(F)F)[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 C13H13F3N4O5 MW 362.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13F3N4O5/c1-8(21)17-2-4-18(5-3-17)12-10(19(22)23)6-9(13(14,15)16)7-11(12)20(24)25/h6-7H,2-5H2,1H3InChIKey
HZXNLLRBDYYHQS-UHFFFAOYSA-NSynonyms
1(4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)ETHANONE
CC(=O)N1CCN(CC1)c1c(cc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
CC(=O)N1CCN(CC1)C2=C(C=C(C=C2(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC13H13F3N4O5c18(21)172418(5317)1210(19(22)23)69(13(1415)16)711(12)20(24)25h67H25H21H3
MFCD03167097
ZINC000004187725
ZINC04187725
ZINC4187725
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Check stock on Vitas-MAvailable files
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