Vitas-M small molecule compound

2-{4-[2,6-dinitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}ethanol

Catalog ID
STK070968
SMILES OCCN1CCN(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 C13H15F3N4O5 MW 364.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15F3N4O5/c14-13(15,16)9-7-10(19(22)23)12(11(8-9)20(24)25)18-3-1-17(2-4-18)5-6-21/h7-8,21H,1-6H2
InChIKey
QBTMMSCUEZTXQX-UHFFFAOYSA-N
Synonyms
5670-54-2
2(4(26BISNITRO4(TRIFLUOROMETHYL)PHENYL)1PIPERAZINYL)ETHANOL
2(4(26DINITRO4(TRIFLUOROMETHYL)PHENYL)PIPERAZIN1YL)ETHANOL
2(4(26DINITRO4TRIFLUOROMETHYLPHENYL)PIPERAZIN1YL)ETHANOL
5670542
C1CN(CCN1CCO)C2=C(C=C(C=C2(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
InChI=1SC13H15F3N4O5c1413(1516)9710(19(22)23)12(11(89)20(24)25)183117(2418)5621h7821H16H2
MFCD01173855
OCCN1CCN(CC1)c1c(cc(cc1(N+)(=O)(O))C(F)(F)F)(N+)(=O)(O)
STK070968
ZINC000019758150
ZINC19758150

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Available files

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