Vitas-M small molecule compound
9-(3-chloro-4-ethoxyphenyl)-3,3,6,6-tetramethyl-3,4,5,6,7,9-hexahydro-1H-xanthene-1,8(2H)-dione
Catalog ID
STK198824
SMILES CCOc1ccc(cc1Cl)C1C2=C(OC3=C1C(=O)CC(C3)(C)C)CC(CC2=O)(C)C
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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 C25H29ClO4 MW 428.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29ClO4/c1-6-29-18-8-7-14(9-15(18)26)21-22-16(27)10-24(2,3)12-19(22)30-20-13-25(4,5)11-17(28)23(20)21/h7-9,21H,6,10-13H2,1-5H3InChIKey
XFDNYZLPXAHAAD-UHFFFAOYSA-NSynonyms
9(3chloro4ethoxyphenyl)3366tetramethyl345679hexahydro1Hxanthene18(2H)dione
9(3chloro4ethoxyphenyl)3366tetramethyl4579tetrahydro2Hxanthene18dione
CCOC1=C(C=C(C=C1)C2C3=C(CC(CC3=O)(C)C)OC4=C2C(=O)CC(C4)(C)C)Cl
InChI=1SC25H29ClO4c1629188714(915(18)26)212216(27)1024(23)1219(22)30201325(45)1117(28)23(20)21h7921H61013H215H3
MFCD03708068
ZINC000001158224
ZINC01158224
ZINC1158224
Check stock
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Check stock on Vitas-MAvailable files
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