Vitas-M small molecule compound
methyl 3,7-dimethyl-1-oxo-3,4-dihydro-1H-isochromene-3-carboxylate
Catalog ID
STL112001
SMILES COC(=O)C1(C)OC(=O)c2c(C1)ccc(c2)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 C13H14O4 MW 234.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14O4/c1-8-4-5-9-7-13(2,12(15)16-3)17-11(14)10(9)6-8/h4-6H,7H2,1-3H3InChIKey
CQSLYJQKAFISLC-UHFFFAOYSA-NSynonyms
890646-76-1890646761
CC1=CC2=C(CC(OC2=O)(C)C(=O)OC)C=C1
InChI=1SC13H14O4c18459713(212(15)163)1711(14)10(9)68h46H7H213H3
methyl37dimethyl1oxo34dihydro1Hisochromene3carboxylate
methyl37dimethyl1oxo4Hisochromene3carboxylate
METHYL37DIMETHYL1OXOISOCHROMANE3CARBOXYLATE
MFCD07802413
ZINC000005033552
ZINC000005033554
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