Basic information
- Standard SMILES
CCOC(=O)CCN(C(C)=O)C1c2ccccc2-c2ccccc21- InChIKey
GLLHMPJULSEZAD-UHFFFAOYSA-N- Molecular formula
- C20H21NO3
- Average molar mass
- 323.4 g/mol
- Monoisotopic mass
- 323.15214353
Names & identifiers
- Preferred name
- N-acetyl-N-(9-fluorenyl)-beta-alanin ethyl ester
- IUPAC
- ethyl 3-[acetyl(9H-fluoren-9-yl)amino]propanoate
Names & synonyms
SCHEMBL9396724GLLHMPJULSEZAD-UHFFFAOYSA-NN-acetyl-N-(9-fluorenyl)-beta-alanin ethyl esterN-acetyl-N-(9-fluorenyl)-beta-alanine ethyl ester
Database identifiers
- PubChem CID
- 19011663
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 442
Related reactions
4 records
Compound notes
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