Vitas-M small molecule compound

N-(3-chloro-4-methylphenyl)-3-methylbutanamide

Catalog ID
STK412567
SMILES CC(CC(=O)Nc1ccc(c(c1)Cl)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 C12H16ClNO MW 225.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16ClNO/c1-8(2)6-12(15)14-10-5-4-9(3)11(13)7-10/h4-5,7-8H,6H2,1-3H3,(H,14,15)
InChIKey
UGIPOPHJKLRDIL-UHFFFAOYSA-N
Synonyms
6119-40-0
6119400
CC1=C(C=C(C=C1)NC(=O)CC(C)C)Cl
InChI=1SC12H16ClNOc18(2)612(15)1410549(3)11(13)710h4578H6H213H3(H1415)
MFCD00995242
N(3chloro4methylphenyl)3methylbutanamide
ZINC000000361710
ZINC00361710
ZINC361710

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Available files

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