Vitas-M small molecule compound
3-ethyl-5,6-dimethyl-1-benzofuran-2-carboxylic acid
Catalog ID
STK967295
SMILES CCc1c(oc2c1cc(C)c(c2)C)C(=O)O
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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 C13H14O3 MW 218.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14O3/c1-4-9-10-5-7(2)8(3)6-11(10)16-12(9)13(14)15/h5-6H,4H2,1-3H3,(H,14,15)InChIKey
FOGBSWYVJIPHRQ-UHFFFAOYSA-NSynonyms
3ethyl56dimethyl1benzofuran2carboxylicacid
3ETHYL56DIMETHYLBENZO(B)FURAN2CARBOXYLICACID
CCC1=C(OC2=CC(=C(C=C21)C)C)C(=O)O
InChI=1SC13H14O3c1491057(2)8(3)611(10)1612(9)13(14)15h56H4H213H3(H1415)
MFCD08550631
ZINC000011914604
ZINC11914604
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