Undecenoyl-aspartyl-dialanyl-proline ethylamide

Base Information

• Chemical Name: Undecenoyl-aspartyl-dialanyl-proline ethylamide
• CAS No.: 90068-11-4
• Molecular Formula: C28H49 N5 O7
• Molecular Weight: 0
• Mol file: 90068-11-4.mol

Synonyms:UAAAPNE;UDE-Asp-(Ala)2-Pro-NHEt;undecenoyl-aspartyl-dialanyl-proline ethylamide

Chemical Property of Undecenoyl-aspartyl-dialanyl-proline ethylamide

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 1002.5°Cat760mmHg
• Flash Point: 560.1°C
• PSA: 278.86000
• Density: 1.247g/cm³
• LogP: 3.62760
• XLogP3: -4.3
• Hydrogen Bond Donor Count: 7
• Hydrogen Bond Acceptor Count: 12
• Rotatable Bond Count: 22
• Exact Mass: 680.37449188
• Heavy Atom Count: 48
• Complexity: 1220

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCC=CC(=O)C1CCN(C1(C(=O)C(C)NC(=O)C(CC(=O)O)N)C(=O)NCC)C(=O)C(C)NC(=O)C(CC(=O)O)N
• Isomeric SMILES: CCCCCCCC/C=C/C(=O)C1CCN([C@]1(C(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)N)C(=O)NCC)C(=O)[C@H](C)NC(=O)[C@H](CC(=O)O)N