Vitas-M small molecule compound

N,N'-[(2,2',3,3',5,5',6,6'-octafluorobiphenyl-4,4'-diyl)bis(oxybenzene-3,1-diyl)]bis(2,2-dimethylpropanamide)

Catalog ID
STK045088
SMILES O=C(C(C)(C)C)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)c1c(F)c(F)c(c(c1F)F)Oc1cccc(c1)NC(=O)C(C)(C)C

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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 C34H28F8N2O4 MW 680.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H28F8N2O4/c1-33(2,3)31(45)43-15-9-7-11-17(13-15)47-29-25(39)21(35)19(22(36)26(29)40)20-23(37)27(41)30(28(42)24(20)38)48-18-12-8-10-16(14-18)44-32(46)34(4,5)6/h7-14H,1-6H3,(H,43,45)(H,44,46)
InChIKey
MRHMOQUZKZUFBD-UHFFFAOYSA-N
Synonyms

CC(C)(C)C(=O)NC1=CC(=CC=C1)OC2=C(C(=C(C(=C2F)F)C3=C(C(=C(C(=C3F)F)OC4=CC=CC(=C4)NC(=O)C(C)(C)C)F)F)F)F
InChI=1SC34H28F8N2O4c133(23)31(45)4315971117(1315)472925(39)21(35)19(22(36)26(29)40)2023(37)27(41)30(28(42)24(20)38)48181281016(1418)4432(46)34(45)6h714H16H3(H4345)(H4446)
MFCD01973958
N(3(4(4(3(22dimethylpropanoylamino)phenoxy)2356tetrafluorophenyl)2356tetrafluorophenoxy)phenyl)22dimethylpropanamide
NN((22335566octafluorobiphenyl44diyl)bis(oxybenzene31diyl))bis(22dimethylpropanamide)
O=C(C(C)(C)C)Nc1cccc(c1)Oc1c(F)c(F)c(c(c1F)F)c1c(F)c(F)c(c(c1F)F)Oc1cccc(c1)NC(=O)C(C)(C)C
STK045088
ZINC000098042836
ZINC98042836

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Available files

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