N-(3-Oxo-3-phenylpropyl)phenylalanine--hydrogen chloride (1/1)
Basic information
- CAS
85975-14-0- Standard SMILES
Cl.O=C(CCN[C@@H](Cc1ccccc1)C(=O)O)c1ccccc1- InChIKey
NDYNEWPNTSXNNO-NTISSMGPSA-N- Molecular formula
- C18H20ClNO3
- Average molar mass
- 333.8 g/mol
- Monoisotopic mass
- 333.11317118
Names & identifiers
- Preferred name
- N-(3-Oxo-3-phenylpropyl)phenylalanine--hydrogen chloride (1/1)
- IUPAC
- (2S)-2-[(3-oxo-3-phenylpropyl)amino]-3-phenylpropanoic acid;hydrochloride
Names & synonyms
85975-14-0DTXSID301006561N-(3-Oxo-3-phenylpropyl)phenylalanine--hydrogen chloride (1/1)RefChem:1091180DTXCID801433430N-(3-Oxo-3-phenylpropyl)-DL-phenylalanine hydrochlorideDL-Phenylalanine, N-(3-oxo-3-phenylpropyl)-, hydrochlorideN-(3-Oxo-3-phenylpropyl)-L-phenylalanine--hydrogen chloride (1/1)
Database identifiers
- CAS
85975-14-0- PubChem CID
- 3070184
- DTXSID
DTXSID301006561
Properties
Computed structural properties
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 357
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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