Vitas-M small molecule compound
9-{4-[(2,4-dichlorobenzyl)oxy]phenyl}-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198812
SMILES Clc1ccc(c(c1)Cl)COc1ccc(cc1)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 C26H22Cl2O4 MW 469.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H22Cl2O4/c27-17-10-7-16(19(28)13-17)14-31-18-11-8-15(9-12-18)24-25-20(29)3-1-5-22(25)32-23-6-2-4-21(30)26(23)24/h7-13,24H,1-6,14H2InChIKey
HGBQMCNBLUJHDY-UHFFFAOYSA-NSynonyms
9(4((24dichlorobenzyl)oxy)phenyl)345679hexahydro1Hxanthene18(2H)dione
9(4((24dichlorophenyl)methoxy)phenyl)345679hexahydro2Hxanthene18dione
C1CC2=C(C(C3=C(O2)CCCC3=O)C4=CC=C(C=C4)OCC5=C(C=C(C=C5)Cl)Cl)C(=O)C1
InChI=1SC26H22Cl2O4c271710716(19(28)1317)14311811815(91218)242520(29)31522(25)322362421(30)26(23)24h71324H1614H2
MFCD03707834
ZINC000002998953
ZINC02998953
ZINC2998953
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