Vitas-M small molecule compound

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

Catalog ID
STK512191
SMILES OC(c1ccccc1)CNCc1ccc(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/c18-15(13-4-2-1-3-5-13)11-17-10-12-6-8-14(9-7-12)16(19)20/h1-9,15,17-18H,10-11H2,(H,19,20)
InChIKey
KTOLFXNSRQLMFD-UHFFFAOYSA-N
Synonyms

4(((2hydroxy2phenylethyl)amino)methyl)benzoicacid
C1=CC=C(C=C1)C(CNCC2=CC=C(C=C2)C(=O)O)O
InChI=1SC16H17NO3c1815(134213513)111710126814(9712)16(19)20h19151718H1011H2(H1920)
MFCD08756677
ZINC000010475265
ZINC000010475266

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Available files

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