Vitas-M small molecule compound

1-heptyl-4-(phenylcarbonyl)pyridinium bromide

Catalog ID
STK091330
SMILES CCCCCCC[n+]1ccc(cc1)C(=O)c1ccccc1.[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 C19H24BrNO MW 362.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H24NO.BrH/c1-2-3-4-5-9-14-20-15-12-18(13-16-20)19(21)17-10-7-6-8-11-17;/h6-8,10-13,15-16H,2-5,9,14H2,1H3;1H/q+1;/p-1
InChIKey
PNSDUBSFXZUIBQ-UHFFFAOYSA-M
Synonyms
62230-98-2
(1heptylpyridin1ium4yl)phenylmethanonebromide
1HEPTYL4(PHENYLCARBONYL)PYRIDINIUMBROMIDE
62230982
CCCCCCC(N+)1=CC=C(C=C1)C(=O)C2=CC=CC=C2(Br)
CCCCCCC(n+)1ccc(cc1)C(=O)c1ccccc1(Br)
InChI=1SC19H24NOBrHc1234591420151218(131620)19(21)17107681117h6810131516H25914H21H31Hq+1p1
MFCD00490949
STK091330
ZINC000001712173

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Available files

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