N-carbonyl l-phenylalanine ethyl ester
ethyl (2S)-2-isocyanato-3-phenylpropanoate
Also Known As: N-carbonyl l-phenylalanine ethyl ester|n-carbonyl-l-phenylalanine ethyl ester|ethyl (2S)-2-isocyanato-3-phenylpropanoate|J1.848.057C|2-isocyanato-3-phenyl-propionic acid ethyl ester|alpha-Deamino-alpha-isocyanatophenylalanine ethyl ester
CAS: 37682-80-7
| Molecular Formula | C12H13NO3 |
|---|---|
| Molecular Weight | 219.08954 g/mol |
| LogP | 1.4966 |
| Topological Polar Surface Area | 55.73 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 219.08954 |
| Monoisotopic Mass | 219.08954 |
| Heavy Atoms | 16 |
| Complexity | 382.51016 |
Chemical Identifiers
| CAS Number | 37682-80-7 |
|---|---|
| SMILES | CCOC(=O)[C@H](CC1=CC=CC=C1)N=C=O |
Product Overview
N-carbonyl l-phenylalanine ethyl ester (CAS 37682-80-7), with molecular formula C12H13NO3 and molecular weight 219.08954 g/mol. IUPAC: ethyl (2S)-2-isocyanato-3-phenylpropanoate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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