Vitas-M small molecule compound

4-methoxy-3-[(3-methylphenoxy)methyl]benzoic acid

Catalog ID
STK349009
SMILES COc1ccc(cc1COc1cccc(c1)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 C16H16O4 MW 272.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16O4/c1-11-4-3-5-14(8-11)20-10-13-9-12(16(17)18)6-7-15(13)19-2/h3-9H,10H2,1-2H3,(H,17,18)
InChIKey
KMWJNHRFMMKBQQ-UHFFFAOYSA-N
Synonyms
438220-78-1
438220781
4methoxy3((3methylphenoxy)methyl)benzoicacid
CC1=CC(=CC=C1)OCC2=C(C=CC(=C2)C(=O)O)OC
InChI=1SC16H16O4c11143514(811)201013912(16(17)18)6715(13)192h39H10H212H3(H1718)
MFCD03419434
ZINC000002549435
ZINC2549435

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Available files

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