alpha-Oxo-4-[[2-(4-phenoxy-phenoxy)ethyl]oxy]benzeneacetic acid methyl ester
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Basic information
- Standard SMILES
COC(=O)C(=O)c1ccc(OCCOc2ccc(Oc3ccccc3)cc2)cc1- InChIKey
ZTJYUUGMZASGPK-UHFFFAOYSA-N- Molecular formula
- C23H20O6
- Average molar mass
- 392.4 g/mol
Names & identifiers
- Preferred name
- alpha-Oxo-4-[[2-(4-phenoxy-phenoxy)ethyl]oxy]benzeneacetic acid methyl ester
- IUPAC
- methyl 2-oxo-2-[4-[2-(4-phenoxyphenoxy)ethoxy]phenyl]acetate
Names & synonyms
SCHEMBL9041291ZTJYUUGMZASGPK-UHFFFAOYSA-Nalpha-oxo-4-[[2-(4-phenoxy-phenoxy)ethyl]oxy]benzeneacetic acid methyl ester
Database identifiers
- PubChem CID
- 54565301
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 499
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Related reactions
2 records
Compound notes
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