Vitas-M small molecule compound

4-oxo-4,5,6,7-tetrahydro-1-benzofuran-2-carboxylic acid

Catalog ID
STL426150
SMILES OC(=O)c1oc2c(c1)C(=O)CCC2

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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 C9H8O4 MW 180.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8O4/c10-6-2-1-3-7-5(6)4-8(13-7)9(11)12/h4H,1-3H2,(H,11,12)
InChIKey
BWONXPWAUSMDDH-UHFFFAOYSA-N
Synonyms
108249-48-5
108249485
4oxo4567tetrahydro1benzofuran2carboxylicacid
4oxo4567tetrahydrobenzofuran2carboxylicacid
4OXO567TRIHYDROBENZO(12B)FURAN2CARBOXYLICACID
4OXO67DIHYDRO5H1BENZOFURAN2CARBOXYLICACID
C1CC2=C(C=C(O2)C(=O)O)C(=O)C1
InChI=1SC9H8O4c10621375(6)48(137)9(11)12h4H13H2(H1112)
MFCD00612516
ZINC000003209433
ZINC3209433

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.