N-Trifluoroacetylphenylalanylalanine
Basic information
- CAS
3801-77-2- Standard SMILES
C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)C(F)(F)F)C(=O)O- InChIKey
CPHPEWFIOVFACR-WPRPVWTQSA-N- Molecular formula
- C14H15F3N2O4
- Average molar mass
- 332.27 g/mol
- Monoisotopic mass
- 332.09839162
Names & identifiers
- Preferred name
- N-Trifluoroacetylphenylalanylalanine
- IUPAC
- (2S)-2-[[(2S)-3-phenyl-2-[(2,2,2-trifluoroacetyl)amino]propanoyl]amino]propanoic acid
- English name
- N-trifluoroacetylphenylalanylalanine
- Molecular weight
- 0
Names & synonyms
N-TrifluoroacetylphenylalanylalanineTfa-phe-ala3801-77-2N-Tfa-phenylalanyl-alanineDTXSID80191425L-Alanine, N-(N-(trifluoroacetyl)-L-phenylalanyl)-RefChem:164278DTXCID90113916N-(Trifluoroacetyl)-L-phenylalanyl-L-alanine
Database identifiers
- CAS
3801-77-2- PubChem CID
- 5489523
- DTXSID
DTXSID80191425
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 95.5 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 448
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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