Vitas-M small molecule compound
6-tert-butyl-3-(trifluoromethyl)-2,3-dihydro-1,4-benzoxathiine
Catalog ID
STK524708
SMILES FC(C1COc2c(S1)cc(cc2)C(C)(C)C)(F)F
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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 C13H15F3OS MW 276.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15F3OS/c1-12(2,3)8-4-5-9-10(6-8)18-11(7-17-9)13(14,15)16/h4-6,11H,7H2,1-3H3InChIKey
BCCUPFGKVCBITR-UHFFFAOYSA-NSynonyms
136603-65-1136603651
14BENZOXATHIIN6(11DIMETHYLETHYL)23DIHYDRO3(TRIFLUOROMETHYL)
6(tertbutyl)3(trifluoromethyl)23dihydrobenzo(b)(14)oxathiine
6tertbutyl3(trifluoromethyl)23dihydro14benzoxathiine
CC(C)(C)C1=CC2=C(C=C1)OCC(S2)C(F)(F)F
InChI=1SC13H15F3OSc112(23)845910(68)1811(7179)13(1415)16h4611H7H213H3
MFCD00434139
ZINC000000497277
ZINC000000497278
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