Vitas-M small molecule compound

4-bromo-2-{[(2,5-dimethoxybenzyl)amino]methyl}phenol

Catalog ID
STK878893
SMILES COc1ccc(cc1CNCc1cc(Br)ccc1O)OC

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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 C16H18BrNO3 MW 352.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18BrNO3/c1-20-14-4-6-16(21-2)12(8-14)10-18-9-11-7-13(17)3-5-15(11)19/h3-8,18-19H,9-10H2,1-2H3
InChIKey
HLQPJKUANXIHMB-UHFFFAOYSA-N
Synonyms
1223889-16-4
1223889164
4bromo2(((25dimethoxybenzyl)amino)methyl)phenol
4bromo2(((25dimethoxyphenyl)methylamino)methyl)phenol
COC1=CC(=C(C=C1)OC)CNCC2=C(C=CC(=C2)Br)O
InChI=1SC16H18BrNO3c120144616(212)12(814)1018911713(17)3515(11)19h381819H910H212H3
MFCD18170399
ZINC000040477065
ZINC40477065

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Available files

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