Vitas-M small molecule compound

1-(5-bromo-2-methoxybenzyl)-1-methylpiperidinium

Catalog ID
STL036722
SMILES COc1ccc(cc1C[N+]1(C)CCCCC1)Br

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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 C14H21BrNO MW 299.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H21BrNO/c1-16(8-4-3-5-9-16)11-12-10-13(15)6-7-14(12)17-2/h6-7,10H,3-5,8-9,11H2,1-2H3/q+1
InChIKey
UEKOACPTNMEUQP-UHFFFAOYSA-N
Synonyms

1((5BROMO2METHOXYPHENYL)METHYL)1METHYLPIPERIDIN1IUM
1(5bromo2methoxybenzyl)1methylpiperidin1iumiodide
1(5bromo2methoxybenzyl)1methylpiperidinium
C(N+)1(CCCCC1)CC2=C(C=CC(=C2)Br)OC
COc1ccc(cc1C(N+)1(C)CCCCC1)Br
COc1ccc(cc1C(N+)1(C)CCCCC1)Br(I)
InChI=1SC14H21BrNOc116(8435916)11121013(15)6714(12)172h6710H358911H212H3q+1
ZINC000000546865
ZINC00546865
ZINC546865

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Available files

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