N-(N-(1-(Ethoxycarbonyl)-3-phenylpropyl)alanyl)-N-(1-pyrrolidinyl)glycine

Base Information

• Chemical Name: N-(N-(1-(Ethoxycarbonyl)-3-phenylpropyl)alanyl)-N-(1-pyrrolidinyl)glycine
• CAS No.: 98056-23-6
• Molecular Formula: C21H31N3O5
• Molecular Weight: 405.4879
• DSSTox Substance ID: DTXSID60913485
• Wikidata: Q82884099
• Mol file: 98056-23-6.mol

Synonyms:N-(N (1-(ethoxycarbonyl)-3-phenylpropyl)alanyl)-N-(1-pyrrolidinyl)glycine;REV 6207;REV-6207

Chemical Property of N-(N-(1-(Ethoxycarbonyl)-3-phenylpropyl)alanyl)-N-(1-pyrrolidinyl)glycine

Chemical Property:

• Vapor Pressure: 3.53E-14mmHg at 25°C
• Boiling Point: 577.5°C at 760 mmHg
• Flash Point: 303.1°C
• Density: 1.22g/cm³
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 12
• Exact Mass: 405.22637110
• Heavy Atom Count: 29
• Complexity: 544

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CCOC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N(CC(=O)O)N2CCCC2
• Isomeric SMILES: CCOC(=O)[C@H](CCC1=CC=CC=C1)N[C@@H](C)C(=O)N(CC(=O)O)N2CCCC2