Vitas-M small molecule compound

ethyl N-(cyanoacetyl)-3,3,3-trifluoro-2-hydroxyalaninate

Catalog ID
STK759254
SMILES CCOC(=O)C(C(F)(F)F)(NC(=O)CC#N)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 C8H9F3N2O4 MW 254.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H9F3N2O4/c1-2-17-6(15)7(16,8(9,10)11)13-5(14)3-4-12/h16H,2-3H2,1H3,(H,13,14)
InChIKey
QXCXNOHFLJAKRD-UHFFFAOYSA-N
Synonyms

ETHYL2((2CYANOACETYL)AMINO)333TRIFLUORO2HYDROXYPROPANOATE
ethylN(cyanoacetyl)333trifluoro2hydroxyalaninate
InChI=1SC8H9F3N2O4c12176(15)7(168(910)11)135(14)3412h16H23H21H3(H1314)
MFCD00278008
ZINC000003138609
ZINC000003138610

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Available files

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