Vitas-M small molecule compound

4-{[(2-methoxybenzyl)amino]methyl}benzoic acid

Catalog ID
STK294238
SMILES COc1ccccc1CNCc1ccc(cc1)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 C16H17NO3 MW 271.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H17NO3/c1-20-15-5-3-2-4-14(15)11-17-10-12-6-8-13(9-7-12)16(18)19/h2-9,17H,10-11H2,1H3,(H,18,19)
InChIKey
UOWPKFCKRQFZTH-UHFFFAOYSA-N
Synonyms
880813-16-1
4(((2methoxybenzyl)amino)methyl)benzoicacid
4(((2METHOXYPHENYL)METHYLAMINO)METHYL)BENZOICACID
4(((2METHOXYPHENYL)METHYLAZANIUMYL)METHYL)BENZOATE
880813161
COC1=CC=CC=C1CNCC2=CC=C(C=C2)C(=O)O
InChI=1SC16H17NO3c12015532414(15)111710126813(9712)16(18)19h2917H1011H21H3(H1819)
MFCD07410338
ZINC000006702338
ZINC06702338
ZINC6702338

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Available files

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