Vitas-M small molecule compound

5-(4-cyanophenyl)furan-2-carboxylic acid

Catalog ID
STL412031
SMILES N#Cc1ccc(cc1)c1ccc(o1)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 C12H7NO3 MW 213.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H7NO3/c13-7-8-1-3-9(4-2-8)10-5-6-11(16-10)12(14)15/h1-6H,(H,14,15)
InChIKey
QSWFKKSKRNCSDY-UHFFFAOYSA-N
Synonyms
52938-94-0
5(4CYANOPHENYL)2FUROICACID
5(4cyanophenyl)furan2carboxylicacid
5(4CYANOPHENYL)FURANE2CARBOXYLICACID
52938940
C1=CC(=CC=C1C#N)C2=CC=C(O2)C(=O)O
InChI=1SC12H7NO3c1378139(428)105611(1610)12(14)15h16H(H1415)
MFCD06802004
ZINC000006863172
ZINC6863172

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Available files

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