Vitas-M small molecule compound

3-butyl-7-ethoxy-4-methyl-2H-chromen-2-one

Catalog ID
STK374262
SMILES CCCCc1c(=O)oc2c(c1C)ccc(c2)OCC

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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 C16H20O3 MW 260.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20O3/c1-4-6-7-14-11(3)13-9-8-12(18-5-2)10-15(13)19-16(14)17/h8-10H,4-7H2,1-3H3
InChIKey
ZCTZZROQPFTOOD-UHFFFAOYSA-N
Synonyms

3butyl7ethoxy4methyl2Hchromen2one
3BUTYL7ETHOXY4METHYLCHROMEN2ONE
CCCCC1=C(C2=C(C=C(C=C2)OCC)OC1=O)C
InChI=1SC16H20O3c14671411(3)139812(1852)1015(13)1916(14)17h810H47H213H3
MFCD01107155
ZINC000004113460
ZINC04113460
ZINC4113460

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Available files

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