Basic information
- Standard SMILES
COCCOCc1ccc(C(C)C(=O)O)cc1F- InChIKey
XSHPLQLEBHKURE-UHFFFAOYSA-N- Molecular formula
- C13H17FO4
- Average molar mass
- 256.27 g/mol
Names & identifiers
- Preferred name
- 2-(3-Fluoro-4-((2-methoxyethoxy)methyl)phenyl)propanoic acid
- IUPAC
- 2-[3-fluoro-4-(2-methoxyethoxymethyl)phenyl]propanoic acid
Names & synonyms
SCHEMBL298678XSHPLQLEBHKURE-UHFFFAOYSA-N2-(3-fluoro-4-((2-methoxyethoxy)methyl)-phenyl)propanoic acid2-(3-fluoro-4-((2-methoxyethoxy)methyl)phenyl)propanoic acid
Database identifiers
- PubChem CID
- 59637270
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 55.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 259
Related reactions
2 records
Compound notes
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