Vitas-M small molecule compound

2-cyanoethyl [1,1,1-trifluoro-2-(trifluoromethyl)butan-2-yl]carbamate

Catalog ID
STK673087
SMILES CCC(C(F)(F)F)(C(F)(F)F)NC(=O)OCCC#N

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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 C9H10F6N2O2 MW 292.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H10F6N2O2/c1-2-7(8(10,11)12,9(13,14)15)17-6(18)19-5-3-4-16/h2-3,5H2,1H3,(H,17,18)
InChIKey
DBDNDMNDHFRTGI-UHFFFAOYSA-N
Synonyms

2cyanoethyl(111trifluoro2(trifluoromethyl)butan2yl)carbamate
2CYANOETHYLN(111TRIFLUORO2(TRIFLUOROMETHYL)BUTAN2YL)CARBAMATE
InChI=1SC9H10F6N2O2c127(8(1011)129(1314)15)176(18)1953416h235H21H3(H1718)
MFCD00575634
ZINC000003189047
ZINC03189047
ZINC3189047

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Available files

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