Vitas-M small molecule compound

6-chloro-3-(2-hydroxypropyl)-4-methyl-7-[2-(4-methylphenyl)-2-oxoethoxy]-2H-chromen-2-one

Catalog ID
STL336240
SMILES CC(Cc1c(=O)oc2c(c1C)cc(c(c2)OCC(=O)c1ccc(cc1)C)Cl)O

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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 C22H21ClO5 MW 400.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClO5/c1-12-4-6-15(7-5-12)19(25)11-27-21-10-20-16(9-18(21)23)14(3)17(8-13(2)24)22(26)28-20/h4-7,9-10,13,24H,8,11H2,1-3H3
InChIKey
UMSXFYYGSCOOPW-UHFFFAOYSA-N
Synonyms
499140-53-3
499140533
6chloro3(2hydroxypropyl)4methyl7(2(4methylphenyl)2oxoethoxy)2Hchromen2one
6CHLORO3(2HYDROXYPROPYL)4METHYL7(2(4METHYLPHENYL)2OXOETHOXY)CHROMEN2ONE
6chloro3(2hydroxypropyl)4methyl7(2oxo2(ptolyl)ethoxy)2Hchromen2one
CC1=CC=C(C=C1)C(=O)COC2=C(C=C3C(=C(C(=O)OC3=C2)CC(C)O)C)Cl
InChI=1SC22H21ClO5c1124615(7512)19(25)112721102016(918(21)23)14(3)17(813(2)24)22(26)2820h479101324H811H213H3
MFCD03272587
ZINC000000641729
ZINC000000641730

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Available files

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