Vitas-M small molecule compound

9-(2,2-dichloroethenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione

Catalog ID
STK832605
SMILES ClC(=CC1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C)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 C19H22Cl2O3 MW 369.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22Cl2O3/c1-18(2)6-11(22)16-10(5-15(20)21)17-12(23)7-19(3,4)9-14(17)24-13(16)8-18/h5,10H,6-9H2,1-4H3
InChIKey
TWUCFMSOLVRUQO-UHFFFAOYSA-N
Synonyms
102163-72-4
102163724
9(22dichloroethenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(22dichloroethenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
9(22dichlorovinyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
CC1(CC2=C(C(C3=C(O2)CC(CC3=O)(C)C)C=C(Cl)Cl)C(=O)C1)C
InChI=1SC19H22Cl2O3c118(2)611(22)1610(515(20)21)1712(23)719(34)914(17)2413(16)818h510H69H214H3
MFCD00550982
ZINC000001232463
ZINC01232463
ZINC1232463

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Available files

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