Vitas-M small molecule compound

4-{[(1-hydroxy-2-methylpropan-2-yl)amino]methyl}benzoic acid

Catalog ID
STK512089
SMILES OCC(NCc1ccc(cc1)C(=O)O)(C)C

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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 C12H17NO3 MW 223.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17NO3/c1-12(2,8-14)13-7-9-3-5-10(6-4-9)11(15)16/h3-6,13-14H,7-8H2,1-2H3,(H,15,16)
InChIKey
HOENOBQBQPUVOJ-UHFFFAOYSA-N
Synonyms
932231-48-6
4(((1hydroxy2methylpropan2yl)amino)methyl)benzoicacid
4(((2HYDROXY11DIMETHYLETHYL)AMINO)METHYL)BENZOICACID
932231486
CC(C)(CO)NCC1=CC=C(C=C1)C(=O)O
InChI=1SC12H17NO3c112(2814)13793510(649)11(15)16h361314H78H212H3(H1516)
MFCD08758095
ZINC000010473865
ZINC10473865

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Available files

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