4H-1-Benzopyran-4-one, 6-methoxy-2-(2-(4-methoxyphenyl)ethyl)-
Basic information
- CAS
111286-05-6- Standard SMILES
COc1ccc(CCc2cc(=O)c3cc(OC)ccc3o2)cc1- InChIKey
RQDQHEBGEUXELB-UHFFFAOYSA-N- Molecular formula
- C19H18O4
- Average molar mass
- 310.3 g/mol
- Monoisotopic mass
- 310.12050905
Overview
4H-1-Benzopyran-4-one, 6-methoxy-2-(2-(4-methoxyphenyl)ethyl)- has been reported in Aquilaria malaccensis with data available.
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 6-methoxy-2-(2-(4-methoxyphenyl)ethyl)-
- IUPAC
- 6-methoxy-2-[2-(4-methoxyphenyl)ethyl]chromen-4-one
Names & synonyms
4H-1-Benzopyran-4-one, 6-methoxy-2-(2-(4-methoxyphenyl)ethyl)-111286-05-6DTXSID901495784H-1-Benzopyran-4-one, 6-methoxy-2-[2-(4-methoxyphenyl)ethyl]-RefChem:100680DTXCID0072069CHEMBL5173435SCHEMBL29128890SCHEMBL30632228RQDQHEBGEUXELB-UHFFFAOYSA-NEthyl 3-[([(diethoxymethyl)(ethoxy)phosphoryl]methyl)(ethoxycarbonyl)amino]propanoate6-Methoxy-2-(4-methoxyphenethyl)-4H-chromen-4-one
Show more names
6-Methoxy-2-[2-(4-methoxyphenyl)ethyl]-4H-1-benzopyran-4-one
Database identifiers
- CAS
111286-05-6- PubChem CID
- 183244
- DTXSID
DTXSID90149578- ChEMBL
CHEMBL5173435
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 437
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Related reactions
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Compound notes
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