Basic information
- Standard SMILES
COCCNC(=O)c1ccc(CCC(=O)O)cc1- InChIKey
WDQAEZIBTRKMSN-UHFFFAOYSA-N- Molecular formula
- C13H17NO4
- Average molar mass
- 251.28 g/mol
Names & identifiers
- Preferred name
- 3-(4-((2-Methoxyethyl)carbamoyl)phenyl)propanoic acid
- IUPAC
- 3-[4-(2-methoxyethylcarbamoyl)phenyl]propanoic acid
Names & synonyms
3-(4-((2-methoxyethyl)carbamoyl)phenyl)propanoic acid1018293-32-7SCHEMBL658505WDQAEZIBTRKMSN-UHFFFAOYSA-NDB-1827023-(4-(2-Methoxyethylcarbamoyl)phenyl)propanoic acidA1-57715
Database identifiers
- PubChem CID
- 28760119
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 272
Related reactions
3 records
Compound notes
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