Lysyl-phenylalanyl-lysine

Base Information

• Chemical Name: Lysyl-phenylalanyl-lysine
• CAS No.: 54925-87-0
• Molecular Formula: C21H35 N5 O4
• Molecular Weight: 421.53
• DSSTox Substance ID: DTXSID60203439
• Nikkaji Number: J825.034K
• Wikidata: Q83076820
• Metabolomics Workbench ID: 83727
• Mol file: 54925-87-0.mol

Synonyms:Lys-Phe-Lys;lysyl-phenylalanyl-lysine

Chemical Property of Lysyl-phenylalanyl-lysine

Chemical Property:

• Vapor Pressure: 4.52E-20mmHg at 25°C
• Boiling Point: 691.4°C at 760 mmHg
• Flash Point: 372°C
• PSA: 173.56000
• Density: 1.22g/cm³
• LogP: 2.75130
• XLogP3: -2.5
• Hydrogen Bond Donor Count: 6
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 15
• Exact Mass: 421.26890461
• Heavy Atom Count: 30
• Complexity: 526

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC(C(=O)NC(CCCCN)C(=O)O)NC(=O)C(CCCCN)N
• Isomeric SMILES: C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCCCN)C(=O)O)NC(=O)[C@H](CCCCN)N

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