2-Amino-3-hydroxy-3-(3-phenylmethoxyphenyl)propanoic acid
Basic information
- CAS
5453-55-4- Standard SMILES
NC(C(=O)O)C(O)c1cccc(OCc2ccccc2)c1- InChIKey
ZAZYQRUXHHRKKK-UHFFFAOYSA-N- Molecular formula
- C16H17NO4
- Average molar mass
- 287.31 g/mol
- Monoisotopic mass
- 287.11575802
Names & identifiers
- Preferred name
- 2-Amino-3-hydroxy-3-(3-phenylmethoxyphenyl)propanoic acid
- IUPAC
- 2-amino-3-hydroxy-3-(3-phenylmethoxyphenyl)propanoic acid
Names & synonyms
5453-55-4NSC187623-(benzyloxy)-DTXSID80280808NSC-187623-(benzyloxy)-beta-hydroxyphenylalanine
Database identifiers
- CAS
5453-55-4- PubChem CID
- 227285
- DTXSID
DTXSID80280808
Properties
Computed structural properties
- XLogP
- -1.1
- Topological polar surface area
- 92.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 330
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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