2-Fluorophenoxy-3-(4-benzyloxyphenyl)-2-methyl-propionic acid ethyl ester
Basic information
- Standard SMILES
CCOC(=O)C(C)(Cc1ccc(OCc2ccccc2)cc1)Oc1ccccc1F- InChIKey
SBOLGANPPMQXEC-UHFFFAOYSA-N- Molecular formula
- C25H25FO4
- Average molar mass
- 408.5 g/mol
- Monoisotopic mass
- 408.17368744
Names & identifiers
- Preferred name
- 2-Fluorophenoxy-3-(4-benzyloxyphenyl)-2-methyl-propionic acid ethyl ester
- IUPAC
- ethyl 2-(2-fluorophenoxy)-2-methyl-3-(4-phenylmethoxyphenyl)propanoate
Names & synonyms
SCHEMBL3992279SBOLGANPPMQXEC-UHFFFAOYSA-N2-Fluorophenoxy-3-(4-benzyloxyphenyl)-2-methyl-propionic acid ethyl ester3-(4-Benzyloxy-phenyl)-2-(2-fluoro- phenoxy)-2-methyl-propionic acid ethyl ester3-(4-Benzyloxy-phenyl)-2-(2-fluoro-phenoxy)-2-methyl-propionic acid ethyl ester3-(4-benzyloxyphenyl)-2-(2-fluorophenoxy)-2-methylpropionic acid ethyl ester
Database identifiers
- PubChem CID
- 57719028
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 10
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 513
Related reactions
5 records
Compound notes
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