Vitas-M small molecule compound

1-(azepan-1-yl)-4-(2,4-dichlorophenoxy)butan-1-one

Catalog ID
STK413064
SMILES Clc1ccc(c(c1)Cl)OCCCC(=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 C16H21Cl2NO2 MW 330.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H21Cl2NO2/c17-13-7-8-15(14(18)12-13)21-11-5-6-16(20)19-9-3-1-2-4-10-19/h7-8,12H,1-6,9-11H2
InChIKey
AJFCMCAKEYKSOV-UHFFFAOYSA-N
Synonyms

1(azepan1yl)4(24dichlorophenoxy)butan1one
1AZAPERHYDROEPINYL4(24DICHLOROPHENOXY)BUTAN1ONE
1AZEPAN1YL4(24DICHLOROPHENOXY)BUTAN1ONE
C1CCCN(CC1)C(=O)CCCOC2=C(C=C(C=C2)Cl)Cl
InChI=1SC16H21Cl2NO2c17137815(14(18)1213)21115616(20)19931241019h7812H16911H2
MFCD00589992
ZINC000002755937
ZINC02755937
ZINC2755937

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Available files

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