Vitas-M small molecule compound
9-(3-chloro-5-ethoxy-4-propoxyphenyl)-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198880
SMILES CCCOc1c(Cl)cc(cc1OCC)C1C2=C(CCCC2=O)OC2=C1C(=O)CCC2
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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 C24H27ClO5 MW 430.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H27ClO5/c1-3-11-29-24-15(25)12-14(13-20(24)28-4-2)21-22-16(26)7-5-9-18(22)30-19-10-6-8-17(27)23(19)21/h12-13,21H,3-11H2,1-2H3InChIKey
MXSZTDHPHPAARP-UHFFFAOYSA-NSynonyms
9(3chloro5ethoxy4propoxyphenyl)345679hexahydro1Hxanthene18(2H)dione
9(3chloro5ethoxy4propoxyphenyl)345679hexahydro2Hxanthene18dione
CCCOC1=C(C=C(C=C1Cl)C2C3=C(CCCC3=O)OC4=C2C(=O)CCC4)OCC
InChI=1SC24H27ClO5c1311292415(25)1214(1320(24)2842)212216(26)75918(22)3019106817(27)23(19)21h121321H311H212H3
MFCD03708235
ZINC000003000176
ZINC03000176
ZINC3000176
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