Vitas-M small molecule compound

6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-4-yl (2,4-dichlorophenoxy)acetate

Catalog ID
STK661444
SMILES O=C(Oc1cccc2c1oc(=O)c1c2CCCC1)COc1ccc(cc1Cl)Cl

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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 C21H16Cl2O5 MW 419.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H16Cl2O5/c22-12-8-9-17(16(23)10-12)26-11-19(24)27-18-7-3-6-14-13-4-1-2-5-15(13)21(25)28-20(14)18/h3,6-10H,1-2,4-5,11H2
InChIKey
QSTUGMIXYCGTPI-UHFFFAOYSA-N
Synonyms

(6oxo78910tetrahydrobenzo(c)chromen4yl)2(24dichlorophenoxy)acetate
6oxo78910tetrahydro6Hbenzo(c)chromen4yl(24dichlorophenoxy)acetate
C1CCC2=C(C1)C3=C(C(=CC=C3)OC(=O)COC4=C(C=C(C=C4)Cl)Cl)OC2=O
InChI=1SC21H16Cl2O5c22128917(16(23)1012)261119(24)27187361413412515(13)21(25)2820(14)18h3610H124511H2
MFCD05257006
ZINC000001441819
ZINC01441819
ZINC1441819

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Available files

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