L-Phenylalanine, 4-(bis(2-chloroethyl)amino)-N-(((4-pyridinylcarbonyl)amino)methyl)-

Base Information

• Chemical Name: L-Phenylalanine, 4-(bis(2-chloroethyl)amino)-N-(((4-pyridinylcarbonyl)amino)methyl)-
• CAS No.: 64398-85-2
• Molecular Formula: C20H24 Cl2 N4 O3
• Molecular Weight: 439.3356
• DSSTox Substance ID: DTXSID20982970
• Wikidata: Q82969847

Synonyms:64398-85-2;L-Phenylalanine, 4-(bis(2-chloroethyl)amino)-N-(((4-pyridinylcarbonyl)amino)methyl)-;C20H24Cl2N4O3;C20-H24-Cl2-N4-O3;L-Phenylalanine, 4-[bis(2-chloroethyl)amino]-N-[[(4-pyridinylcarbonyl)amino]methyl]-;DTXSID20982970;4-[Bis(2-chloroethyl)amino]-N-{[(pyridine-4-carbonyl)amino]methyl}phenylalanine

Chemical Property of L-Phenylalanine, 4-(bis(2-chloroethyl)amino)-N-(((4-pyridinylcarbonyl)amino)methyl)-

Chemical Property:

• Vapor Pressure: 4.09E-20mmHg at 25°C
• Boiling Point: 692.2°Cat760mmHg
• Flash Point: 372.4°C
• Density: 1.328g/cm³
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 12
• Exact Mass: 438.1225460
• Heavy Atom Count: 29
• Complexity: 492

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1CC(C(=O)O)NCNC(=O)C2=CC=NC=C2)N(CCCl)CCCl
• Isomeric SMILES: C1=CC(=CC=C1C[C@@H](C(=O)O)NCNC(=O)C2=CC=NC=C2)N(CCCl)CCCl

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