3-(4-Methoxyphenyl)-4-methylchromen-2-one
Basic information
- CAS
26087-09-2- Standard SMILES
COc1ccc(-c2c(C)c3ccccc3oc2=O)cc1- InChIKey
NTMFLYCPLGOGIP-UHFFFAOYSA-N- Molecular formula
- C17H14O3
- Average molar mass
- 266.29 g/mol
Names & identifiers
- Preferred name
- 3-(4-Methoxyphenyl)-4-methylchromen-2-one
- IUPAC
- 3-(4-methoxyphenyl)-4-methylchromen-2-one
- English name
- 3(4'-Methoxyphenyl)-4-methylcoumarin
- Molecular formula
- C17H14O3
- Molecular weight
- 266.29
Names & synonyms
3-(4-methoxyphenyl)-4-methylchromen-2-one26087-09-23(4'-Methoxyphenyl)-4-methylcoumarin3(4-Methoxyphenyl)-4-methylcoumarin3-(4'-methoxyphenyl)-4-methylcoumarinTimTec1_006350SCHEMBL7117054CHEMBL1172523NTMFLYCPLGOGIP-UHFFFAOYSA-NDTXSID101371271HMS1552A14AKOS024282766
Show more names
ST0584372H-1-Benzopyran-2-one, 3-(4-methoxyphenyl)-4-methyl-3-(4 inverted exclamation mark -Methoxyphenyl)-4-methylcoumarin
Database identifiers
- CAS
26087-09-2- ChEMBL
CHEMBL1172523- Nikkaji
- J3.688.259J
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 404
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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