Vitas-M small molecule compound

methyl N-[(benzyloxy)carbonyl]-3,3,3-trifluoro-2-hydroxyalaninate

Catalog ID
STK792099
SMILES COC(=O)C(C(F)(F)F)(NC(=O)OCc1ccccc1)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 C12H12F3NO5 MW 307.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12F3NO5/c1-20-9(17)11(19,12(13,14)15)16-10(18)21-7-8-5-3-2-4-6-8/h2-6,19H,7H2,1H3,(H,16,18)
InChIKey
MOLRVRSQBNZTTO-UHFFFAOYSA-N
Synonyms

COC(=O)C(C(F)(F)F)(NC(=O)OCC1=CC=CC=C1)O
InChI=1SC12H12F3NO5c1209(17)11(1912(1314)15)1610(18)2178532468h2619H7H21H3(H1618)
METHYL333TRIFLUORO2HYDROXY2(PHENYLMETHOXYCARBONYLAMINO)PROPANOATE
methylN((benzyloxy)carbonyl)333trifluoro2hydroxyalaninate
MFCD03763694
PROPIONICACID2BENZYLOXYCARBONYLAMINO333TRIFLUORO2HYDROXYMETHYLESTER
ZINC000003622589
ZINC000003622591

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Available files

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