Vitas-M small molecule compound

2-bromo-N-(4-methylbenzyl)butanamide

Catalog ID
STL185609
SMILES CCC(C(=O)NCc1ccc(cc1)C)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 C12H16BrNO MW 270.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16BrNO/c1-3-11(13)12(15)14-8-10-6-4-9(2)5-7-10/h4-7,11H,3,8H2,1-2H3,(H,14,15)
InChIKey
JKZYIOVUUVVREE-UHFFFAOYSA-N
Synonyms
1242932-32-6
1242932326
2bromoN((4methylphenyl)methyl)butanamide
2bromoN(4methylbenzyl)butanamide
CCC(C(=O)NCC1=CC=C(C=C1)C)Br
InChI=1SC12H16BrNOc1311(13)12(15)14810649(2)5710h4711H38H212H3(H1415)
MFCD03030366
ZINC000045796270
ZINC000045796271

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Available files

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