2H-1-Benzopyran-3-ol, 3,4-dihydro-5,7-dimethoxy-2-(4-methoxyphenyl)-
Basic information
- CAS
98637-91-3- Standard SMILES
COc1ccc(C2Oc3cc(OC)cc(OC)c3CC2O)cc1- InChIKey
NMLBREXWQRPOJH-UHFFFAOYSA-N- Molecular formula
- C18H20O5
- Average molar mass
- 316.3 g/mol
- Monoisotopic mass
- 316.13107373
Overview
2H-1-Benzopyran-3-ol, 3,4-dihydro-5,7-dimethoxy-2-(4-methoxyphenyl)- is an ether and a member of flavonoids.
Names & identifiers
- Preferred name
- 2H-1-Benzopyran-3-ol, 3,4-dihydro-5,7-dimethoxy-2-(4-methoxyphenyl)-
- IUPAC
- 5,7-dimethoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-3-ol
Names & synonyms
2H-1-Benzopyran-3-ol, 3,4-dihydro-5,7-dimethoxy-2-(4-methoxyphenyl)-98637-91-3DTXSID80344499RefChem:268339DTXCID402955745,7,4'-TrimethoxyafzelechinCHEMBL1488329CHEBI:1812215,7-dimethoxy-2-(4-methoxyphenyl)-3,4-dihydro-2H-chromen-3-olNCGC00095809-015,7-DIMETHOXY-2-(4-METHOXYPHENYL)-3,4-DIHYDRO-2H-1-BENZOPYRAN-3-OL
Database identifiers
- CAS
98637-91-3- PubChem CID
- 597429
- DTXSID
DTXSID80344499- ChEMBL
CHEMBL1488329- ChEBI
CHEBI:181221
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 57.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 368
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Related reactions
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Compound notes
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