Vitas-M small molecule compound
6,7-dimethyl-2-[4-(propan-2-yl)phenyl]-4a,5,8,8a-tetrahydronaphthalene-1,4-dione
Catalog ID
STL017280
SMILES O=C1C=C(c2ccc(cc2)C(C)C)C(=O)C2C1CC(=C(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 C21H24O2 MW 308.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24O2/c1-12(2)15-5-7-16(8-6-15)17-11-20(22)18-9-13(3)14(4)10-19(18)21(17)23/h5-8,11-12,18-19H,9-10H2,1-4H3InChIKey
MLMNLWHCQZYAKM-UHFFFAOYSA-NSynonyms
(4AR8AS)67DIMETHYL2(4(PROPAN2YL)PHENYL)4A588ATETRAHYDRONAPHTHALENE14DIONE(4AS8AS)67DIMETHYL2(4(PROPAN2YL)PHENYL)4A588ATETRAHYDRONAPHTHALENE14DIONE
67dimethyl2(4(propan2yl)phenyl)4a588atetrahydronaphthalene14dione
67dimethyl2(4propan2ylphenyl)4a588atetrahydronaphthalene14dione
CC1=C(CC2C(C1)C(=O)C=C(C2=O)C3=CC=C(C=C3)C(C)C)C
Registry IDs
MFCD05847250ZINC000002685708
ZINC000100879848
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