Vitas-M small molecule compound

3-(4'-octylbiphenyl-4-yl)-5-[4-(undecafluoropentyl)phenyl]-1,2,4-oxadiazole

Catalog ID
STK037722
SMILES CCCCCCCCc1ccc(cc1)c1ccc(cc1)c1noc(n1)c1ccc(cc1)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F

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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 C33H29F11N2O MW 678.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29F11N2O/c1-2-3-4-5-6-7-8-21-9-11-22(12-10-21)23-13-15-24(16-14-23)27-45-28(47-46-27)25-17-19-26(20-18-25)29(34,35)30(36,37)31(38,39)32(40,41)33(42,43)44/h9-20H,2-8H2,1H3
InChIKey
IWUUHBFFLMNEDD-UHFFFAOYSA-N
Synonyms

3(4(4octylphenyl)phenyl)5(4(11223344555undecafluoropentyl)phenyl)124oxadiazole
3(4OCTYLBIPHENYL4YL)5(4(UNDECAFLUOROPENTYL)PHENYL)124OXADIAZOLE
3(4OCTYLBIPHENYL4YL)5(4UNDECAFLUOROPENTYLPHENYL)(124)OXADIAZOLE
CCCCCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=NOC(=N3)C4=CC=C(C=C4)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
CCCCCCCCc1ccc(cc1)c1ccc(cc1)c1noc(n1)c1ccc(cc1)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F
InChI=1SC33H29F11N2Oc123456782191122(121021)23131524(161423)274528(474627)25171926(201825)29(3435)30(3637)31(3839)32(4041)33(4243)44h920H28H21H3
MFCD00610143
STK037722
ZINC000098000409
ZINC98000409

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Available files

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