3-(3,4-dimethoxyphenyl)-6-methoxy-4-methyl-2H-chromen-2-one
Basic information
- CAS
720674-34-0- Standard SMILES
COc1ccc2oc(=O)c(-c3ccc(OC)c(OC)c3)c(C)c2c1- InChIKey
ZLUUGWXFURLGOJ-UHFFFAOYSA-N- Molecular formula
- C19H18O5
- Average molar mass
- 326.3 g/mol
- Monoisotopic mass
- 326.11542367
Names & identifiers
- Preferred name
- 3-(3,4-dimethoxyphenyl)-6-methoxy-4-methyl-2H-chromen-2-one
- IUPAC
- 3-(3,4-dimethoxyphenyl)-6-methoxy-4-methylchromen-2-one
Names & synonyms
720674-34-03-(3,4-dimethoxyphenyl)-6-methoxy-4-methyl-2H-chromen-2-one3-(3',4'-Dimethoxyphenyl)-6-methoxy-4-methylcoumarin3-(3,4-dimethoxyphenyl)-6-methoxy-4-methylchromen-2-one3-(3,4-Dimethoxyphenyl)-6-methoxy-4-methylcoumarinZLUUGWXFURLGOJ-UHFFFAOYSA-NDTXSID801369437STL512034AKOS002068825NCGC00274718-01ST50308855AB01277412-01
Show more names
SR-01000018029SR-01000018029-13(3',4'-Dimethoxyphenyl)-6-methoxy-4-methylcoumarinF1865-02233-(3,4-dimethoxyphenyl)-6-methoxy-4-methyl-2H-1-benzopyran-2-one2H-1-Benzopyran-2-one, 3-(3,4-dimethoxyphenyl)-6-methoxy-4-methyl-3-(3 inverted exclamation mark ,4 inverted exclamation mark -Dimethoxyphenyl)-6-methoxy-4-methylcoumarin
Database identifiers
- CAS
720674-34-0- PubChem CID
- 688770
- DTXSID
DTXSID801369437
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 54 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 500
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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