Valyl-phenylalanyl-lysine chloromethyl ketone

Base Information

• Chemical Name: Valyl-phenylalanyl-lysine chloromethyl ketone
• CAS No.: 75590-17-9
• Molecular Formula: C21H33 Cl N4 O3
• Molecular Weight: 461.43
• DSSTox Substance ID: DTXSID60226502
• Wikidata: Q83105948
• Mol file: 75590-17-9.mol

Synonyms:D-Val-Phe-Lys-chloromethyl ketone;valyl-phenylalanyl-lysine chloromethyl ketone

Chemical Property of Valyl-phenylalanyl-lysine chloromethyl ketone

Chemical Property:

• Vapor Pressure: 2.8E-15mmHg at 25°C
• Boiling Point: 619.6°C at 760 mmHg
• PKA: 13.06±0.46(Predicted)
• Flash Point: 328.5°C
• PSA: 130.80000
• Density: 1.16g/cm³
• LogP: 3.75070
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 13
• Exact Mass: 424.2241186
• Heavy Atom Count: 29
• Complexity: 524

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)NC(=O)C(CC1=CC=CC=C1)NC(CCCCN)C(=O)CCl)N
• Isomeric SMILES: CC(C)[C@H](C(=O)NC(=O)[C@H](CC1=CC=CC=C1)N[C@@H](CCCCN)C(=O)CCl)N

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