Vitas-M small molecule compound
4-{[1,1,1,3,3,3-hexafluoro-2-(methoxycarbonyl)propan-2-yl]sulfanyl}-3-methylphenyl benzoate
Catalog ID
STK548855
SMILES COC(=O)C(C(F)(F)F)(C(F)(F)F)Sc1ccc(cc1C)OC(=O)c1ccccc1
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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 C19H14F6O4S MW 452.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14F6O4S/c1-11-10-13(29-15(26)12-6-4-3-5-7-12)8-9-14(11)30-17(16(27)28-2,18(20,21)22)19(23,24)25/h3-10H,1-2H3InChIKey
UFHFLHVMUXZEMT-UHFFFAOYSA-NSynonyms
339349-25-6(4(111333hexafluoro2methoxycarbonylpropan2yl)sulfanyl3methylphenyl)benzoate
339349256
4((111333hexafluoro2(methoxycarbonyl)propan2yl)sulfanyl)3methylphenylbenzoate
4((111333hexafluoro2(methoxycarbonyl)propan2yl)thio)3methylphenylbenzoate
CC1=C(C=CC(=C1)OC(=O)C2=CC=CC=C2)SC(C(=O)OC)(C(F)(F)F)C(F)(F)F
InChI=1SC19H14F6O4Sc1111013(2915(26)126435712)8914(11)3017(16(27)28218(2021)22)19(2324)25h310H12H3
MFCD00788345
ZINC000002360195
ZINC02360195
ZINC2360195
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