H-D-Ala-D-Phe-OH
Basic information
- CAS
3061-94-7- Standard SMILES
C[C@@H](N)C(=O)N[C@H](Cc1ccccc1)C(=O)O- InChIKey
OMNVYXHOSHNURL-PSASIEDQSA-N- Molecular formula
- C12H16N2O3
- Average molar mass
- 236.27 g/mol
- Monoisotopic mass
- 236.11609237
Names & identifiers
- Preferred name
- H-D-Ala-D-Phe-OH
- IUPAC
- (2R)-2-[[(2R)-2-aminopropanoyl]amino]-3-phenylpropanoic acid
- English name
- H-D-Ala-D-Phe-OH
- Molecular formula
- C12H16N2O3
- Molecular weight
- 236.27
Names & synonyms
H-D-Ala-D-Phe-OH3061-94-7H-D-Ala-D-Phe-OH hydrate(2R)-2-[[(2R)-2-aminopropanoyl]amino]-3-phenylpropanoic acidD-Alanyl-D-phenylalanineSCHEMBL28142226DTXSID801318860FA107974H-D-ALA-D-PHE-OH H2OD-Phenylalanine, D-alanyl-H-D-Ala-D-Phe-OH trifluroacetate
Database identifiers
- CAS
3061-94-7- PubChem CID
- 6992400
- DTXSID
DTXSID801318860- Nikkaji
- J215.760H
Properties
Computed structural properties
- XLogP
- -2.5
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- storage temp.
- -15 °C · -15°C
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Related reactions
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Compound notes
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