Vitas-M small molecule compound

methyl {6-chloro-4-methyl-7-[(3-methylbenzyl)oxy]-2-oxo-2H-chromen-3-yl}acetate

Catalog ID
STK716803
SMILES COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2)OCc1cccc(c1)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 C21H19ClO5 MW 386.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19ClO5/c1-12-5-4-6-14(7-12)11-26-19-10-18-15(8-17(19)22)13(2)16(21(24)27-18)9-20(23)25-3/h4-8,10H,9,11H2,1-3H3
InChIKey
GSFKUOACWCPTEK-UHFFFAOYSA-N
Synonyms
577982-23-1
577982231
CC1=CC(=CC=C1)COC2=C(C=C3C(=C(C(=O)OC3=C2)CC(=O)OC)C)Cl
InChI=1SC21H19ClO5c11254614(712)112619101815(817(19)22)13(2)16(21(24)2718)920(23)253h4810H911H213H3
methyl(6chloro4methyl7((3methylbenzyl)oxy)2oxo2Hchromen3yl)acetate
methyl2(6chloro4methyl7((3methylbenzyl)oxy)2oxo2Hchromen3yl)acetate
METHYL2(6CHLORO4METHYL7((3METHYLPHENYL)METHOXY)2OXOCHROMEN3YL)ACETATE
MFCD04021604
ZINC000002335822
ZINC02335822
ZINC2335822

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Available files

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