Vitas-M small molecule compound
2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-4,5-dimethylphenyl acetate
Catalog ID
STK774498
SMILES CC(=O)Oc1cc(C)c(cc1C(C(F)(F)F)(C(F)(F)F)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 C13H12F6O3 MW 330.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12F6O3/c1-6-4-9(10(5-7(6)2)22-8(3)20)11(21,12(14,15)16)13(17,18)19/h4-5,21H,1-3H3InChIKey
QGPYHSRQPTYQSO-UHFFFAOYSA-NSynonyms
(2(111333hexafluoro2hydroxypropan2yl)45dimethylphenyl)acetate
2(111333hexafluoro2hydroxypropan2yl)45dimethylphenylacetate
ACETICACID45DIMETHYL2(222TRIFLUORO1HYDROXY1TRIFLUOROMETHYLETHYL)PHENYLESTER
CC1=CC(=C(C=C1C)OC(=O)C)C(C(F)(F)F)(C(F)(F)F)O
InChI=1SC13H12F6O3c1649(10(57(6)2)228(3)20)11(2112(1415)16)13(1718)19h4521H13H3
MFCD04060889
ZINC000000118767
ZINC00118767
ZINC118767
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