Vitas-M small molecule compound

2,3,3,3-tetrafluoro-2-[1,1,2,3,3,3-hexafluoro-2-(heptafluoropropoxy)propoxy]-N-(4-nitrophenyl)propanamide

Catalog ID
STK539837
SMILES O=C(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)Nc1ccc(cc1)[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 C15H5F17N2O5 MW 616.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H5F17N2O5/c16-8(11(20,21)22,7(35)33-5-1-3-6(4-2-5)34(36)37)38-15(31,32)10(19,13(26,27)28)39-14(29,30)9(17,18)12(23,24)25/h1-4H,(H,33,35)
InChIKey
WPNSMBKTSSLOGG-UHFFFAOYSA-N
Synonyms

(2S)2333tetrafluoro2(112333hexafluoro2(perfluoropropoxy)propoxy)N(4nitrophenyl)propanamide
2333tetrafluoro2(112333hexafluoro2(1122333heptafluoropropoxy)propoxy)N(4nitrophenyl)propanamide
2333tetrafluoro2(112333hexafluoro2(heptafluoropropoxy)propoxy)N(4nitrophenyl)propanamide
C1=CC(=CC=C1NC(=O)C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)(N+)(=O)(O)
InChI=1SC15H5F17N2O5c168(11(2021)227(35)335136(425)34(36)37)3815(3132)10(1913(2627)28)3914(2930)9(1718)12(2324)25h14H(H3335)
MFCD00291065
O=C(C(C(F)(F)F)(OC(C(C(F)(F)F)(OC(C(C(F)(F)F)(F)F)(F)F)F)(F)F)F)Nc1ccc(cc1)(N+)(=O)(O)
ZINC000095100615
ZINC000095100618

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.