Vitas-M small molecule compound

azepan-1-yl(2,4-dichlorophenyl)methanone

Catalog ID
STK414161
SMILES Clc1ccc(c(c1)Cl)C(=O)N1CCCCCC1

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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 C13H15Cl2NO MW 272.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15Cl2NO/c14-10-5-6-11(12(15)9-10)13(17)16-7-3-1-2-4-8-16/h5-6,9H,1-4,7-8H2
InChIKey
KNRNOZJNAAMSHB-UHFFFAOYSA-N
Synonyms

1(24DICHLOROBENZOYL)AZEPANE
AZAPERHYDROEPINYL24DICHLOROPHENYLKETONE
azepan1yl(24dichlorophenyl)methanone
C1CCCN(CC1)C(=O)C2=C(C=C(C=C2)Cl)Cl
InChI=1SC13H15Cl2NOc14105611(12(15)910)13(17)1673124816h569H1478H2
MFCD00476956
ZINC000000292728
ZINC00292728
ZINC292728

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Available files

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