Vitas-M small molecule compound
5-[(3-chlorobenzyl)oxy]-4-oxo-4H-pyran-2-carboxylic acid
Catalog ID
STL161728
SMILES Clc1cccc(c1)COc1coc(cc1=O)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 C13H9ClO5 MW 280.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9ClO5/c14-9-3-1-2-8(4-9)6-18-12-7-19-11(13(16)17)5-10(12)15/h1-5,7H,6H2,(H,16,17)InChIKey
BVEGIEHPJMSPKU-UHFFFAOYSA-NSynonyms
1040349-00-51040349005
5((3chlorobenzyl)oxy)4oxo4Hpyran2carboxylicacid
5((3chlorophenyl)methoxy)4oxopyran2carboxylicacid
C1=CC(=CC(=C1)Cl)COC2=COC(=CC2=O)C(=O)O
InChI=1SC13H9ClO5c1493128(49)6181271911(13(16)17)510(12)15h157H6H2(H1617)
MFCD16171007
ZINC000045922707
ZINC45922707
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