Vitas-M small molecule compound

methyl 3,3,3-trifluoro-2,2-bis(4-hydroxy-3,5-dimethylphenyl)propanoate

Catalog ID
STK678721
SMILES COC(=O)C(C(F)(F)F)(c1cc(C)c(c(c1)C)O)c1cc(C)c(c(c1)C)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 C20H21F3O4 MW 382.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21F3O4/c1-10-6-14(7-11(2)16(10)24)19(18(26)27-5,20(21,22)23)15-8-12(3)17(25)13(4)9-15/h6-9,24-25H,1-5H3
InChIKey
WBJZQMAPTLCCRE-UHFFFAOYSA-N
Synonyms

333TRIFLUORO22BIS(4HYDROXY35DIMETHYLPHENYL)PROPIONICACIDMETHYLESTER
CC1=CC(=CC(=C1O)C)C(C2=CC(=C(C(=C2)C)O)C)(C(=O)OC)C(F)(F)F
InChI=1SC20H21F3O4c110614(711(2)16(10)24)19(18(26)27520(2122)23)15812(3)17(25)13(4)915h692425H15H3
METHYL22BIS(4HYDROXY35DIMETHYLPHENYL)333TRIFLUOROPROPANOATE
methyl333trifluoro22bis(4hydroxy35dimethylphenyl)propanoate
MFCD03307899
ZINC000004593629
ZINC04593629
ZINC4593629

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Available files

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