Basic information
- Standard SMILES
COC(=O)CCCc1ccccc1N- InChIKey
RPKRGKMXEAFIOQ-UHFFFAOYSA-N- Molecular formula
- C11H15NO2
- Average molar mass
- 193.24 g/mol
Names & identifiers
- Preferred name
- Methyl 4-(2-aminophenyl)butanoate
- IUPAC
- methyl 4-(2-aminophenyl)butanoate
Names & synonyms
Methyl 4-(2-aminophenyl)butanoate46320-17-64-(2-Aminophenyl)butanoic acid methyl esterSCHEMBL1787169RPKRGKMXEAFIOQ-UHFFFAOYSA-NDA-056834-(2-amino-phenyl)-butyric acid methyl esterEN300-2008310
Database identifiers
- PubChem CID
- 237256
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 182
Related reactions
15 records
Compound notes
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