Vitas-M small molecule compound
3-(2-hydroxy-4,4-dimethyl-6-oxocyclohex-1-en-1-yl)-2-benzofuran-1(3H)-one
Catalog ID
STK234985
SMILES OC1=C(C(=O)CC(C1)(C)C)C1OC(=O)c2c1cccc2
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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 C16H16O4 MW 272.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16O4/c1-16(2)7-11(17)13(12(18)8-16)14-9-5-3-4-6-10(9)15(19)20-14/h3-6,14,17H,7-8H2,1-2H3InChIKey
FPKJTAHGXYLASC-UHFFFAOYSA-NSynonyms
139484-19-8139484198
3(2HYDROXY44DIMETHYL6OXO1CYCLOHEXENYL)ISOBENZOFURAN1(3H)ONE
3(2hydroxy44dimethyl6oxocyclohex1en1yl)2benzofuran1(3H)one
3(2HYDROXY44DIMETHYL6OXOCYCLOHEX1EN1YL)ISOBENZOFURAN1(3H)ONE
3(2hydroxy44dimethyl6oxocyclohexen1yl)3H2benzofuran1one
3(6HYDROXY44DIMETHYL2OXOCYCLOHEX1(6)ENYL)3HYDROISOBENZOFURAN1ONE
CC1(CC(=C(C(=O)C1)C2C3=CC=CC=C3C(=O)O2)O)C
InChI=1SC16H16O4c116(2)711(17)13(12(18)816)149534610(9)15(19)2014h361417H78H212H3
MFCD07423868
ZINC000006661556
ZINC000006661558
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