Vitas-M small molecule compound
2-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)benzoic acid
Catalog ID
STL191161
SMILES O=C(c1ccccc1C(=O)O)c1ccc2c(c1)OCCO2
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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 C16H12O5 MW 284.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12O5/c17-15(11-3-1-2-4-12(11)16(18)19)10-5-6-13-14(9-10)21-8-7-20-13/h1-6,9H,7-8H2,(H,18,19)InChIKey
RDAMIKQPKPXITI-UHFFFAOYSA-NSynonyms
568555-82-82(23dihydro14benzodioxin6ylcarbonyl)benzoicacid
2(23DIHYDRO14BENZODIOXINE6CARBONYL)BENZOICACID
2(23DIHYDROBENZO(14)DIOXINE6CARBONYL)BENZOICACID
2(2H3HBENZO(34E)14DIOXAN6YLCARBONYL)BENZOICACID
568555828
C1COC2=C(O1)C=CC(=C2)C(=O)C3=CC=CC=C3C(=O)O
InChI=1SC16H12O5c1715(11312412(11)16(18)19)10561314(910)21872013h169H78H2(H1819)
MFCD03982033
ZINC000003249563
ZINC3249563
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