Vitas-M small molecule compound
7,7-dimethyl-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydro-2H-chromene-2,5(3H)-dione
Catalog ID
STK776118
SMILES O=C1OC2=C(C(C1)c1ccc(cc1)C(F)(F)F)C(=O)CC(C2)(C)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 C18H17F3O3 MW 338.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F3O3/c1-17(2)8-13(22)16-12(7-15(23)24-14(16)9-17)10-3-5-11(6-4-10)18(19,20)21/h3-6,12H,7-9H2,1-2H3InChIKey
HCPONFOALFDDNU-UHFFFAOYSA-NSynonyms
77dimethyl4(4(trifluoromethyl)phenyl)3468tetrahydrochromene25dione
77dimethyl4(4(trifluoromethyl)phenyl)4678tetrahydro2Hchromene25(3H)dione
CC1(CC2=C(C(CC(=O)O2)C3=CC=C(C=C3)C(F)(F)F)C(=O)C1)C
InChI=1SC18H17F3O3c117(2)813(22)1612(715(23)2414(16)917)103511(6410)18(1920)21h3612H79H212H3
MFCD05258513
ZINC000001422987
ZINC000001422988
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