Vitas-M small molecule compound
2-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)-5-methylphenyl acetate
Catalog ID
STK769762
SMILES CC(=O)Oc1cc(C)ccc1C(C(F)(F)F)(C(F)(F)F)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 C12H10F6O3 MW 316.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10F6O3/c1-6-3-4-8(9(5-6)21-7(2)19)10(20,11(13,14)15)12(16,17)18/h3-5,20H,1-2H3InChIKey
TYRLBHKAPZWQRS-UHFFFAOYSA-NSynonyms
(2(111333hexafluoro2hydroxypropan2yl)5methylphenyl)acetate
2(111333hexafluoro2hydroxypropan2yl)5methylphenylacetate
CC1=CC(=C(C=C1)C(C(F)(F)F)(C(F)(F)F)O)OC(=O)C
InChI=1SC12H10F6O3c16348(9(56)217(2)19)10(2011(1314)15)12(1617)18h3520H12H3
MFCD02943175
ZINC000000094187
ZINC00094187
ZINC94187
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