4-butyl-8-methyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one

Chemical Structure Depiction of
4-butyl-8-methyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
Available: 35 mg
Amount:
mg
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Compound characteristics

Compound ID: Y041-1391
Compound Name: 4-butyl-8-methyl-7-[2-(3-nitrophenyl)-2-oxoethoxy]-2H-1-benzopyran-2-one
Molecular Weight: 395.41
Molecular Formula: C22 H21 N O6
Smiles: CCCCC1=CC(=O)Oc2c1ccc(c2C)OCC(c1cccc(c1)[N+]([O-])=O)=O
Stereo: ACHIRAL
logP: 5.0455
logD: 5.0455
logSw: -4.8365
Hydrogen bond acceptors count: 10
Polar surface area: 74.273
InChI Key: ZAIBDGUZARIHLJ-UHFFFAOYSA-N
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