Vitas-M small molecule compound

methyl 2-{4-[acetyl(butyl)amino]phenyl}-3,3,3-trifluoro-2-hydroxypropanoate

Catalog ID
STK373258
SMILES CCCCN(c1ccc(cc1)C(C(F)(F)F)(C(=O)OC)O)C(=O)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 C16H20F3NO4 MW 347.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20F3NO4/c1-4-5-10-20(11(2)21)13-8-6-12(7-9-13)15(23,14(22)24-3)16(17,18)19/h6-9,23H,4-5,10H2,1-3H3
InChIKey
MLXRCUATNFUBRA-UHFFFAOYSA-N
Synonyms

CCCCN(C1=CC=C(C=C1)C(C(=O)OC)(C(F)(F)F)O)C(=O)C
InChI=1SC16H20F3NO4c1451020(11(2)21)138612(7913)15(2314(22)243)16(1718)19h6923H4510H213H3
methyl2(4(acetyl(butyl)amino)phenyl)333trifluoro2hydroxypropanoate
METHYL2(4(NBUTYLACETYLAMINO)PHENYL)333TRIFLUORO2HYDROXYPROPANOATE
MFCD00780102
ZINC000003100043
ZINC000003100044

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Available files

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