Boc-phepsi(CH(OH)CH2)phe-val-phe-morpholine

Base Information

• Chemical Name: Boc-phepsi(CH(OH)CH2)phe-val-phe-morpholine
• CAS No.: 150736-68-8
• Molecular Formula: C42H56 N4 O7
• Molecular Weight: 728.925
• DSSTox Substance ID: DTXSID40934052
• Mol file: 150736-68-8.mol

Synonyms:Boc-Phe-psi(CH(OH)CH2)-Phe-Val-Phe-morpholine;Boc-phenylalanylpsi(CH(OH)CH2)phenylalanyl-valyl-phenylalanyl-morpholine;Boc-Phepsi(CH(OH)CH2)Phe-Val-Phe-morpholine;CGP 53437;CGP-53437

Chemical Property of Boc-phepsi(CH(OH)CH2)phe-val-phe-morpholine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 959.4°C at 760 mmHg
• Flash Point: 534°C
• PSA: 146.30000
• Density: 1.169g/cm³
• LogP: 5.57000
• XLogP3: 5.8
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 18
• Exact Mass: 728.41490014
• Heavy Atom Count: 53
• Complexity: 1130

Purity/Quality:

CGP 53437 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C(C(=O)NC(CC1=CC=CC=C1)C(=O)N2CCOCC2)NC(=O)C(CC3=CC=CC=C3)CC(C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C)O
• Isomeric SMILES: CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N2CCOCC2)NC(=O)[C@H](CC3=CC=CC=C3)C[C@@H](C(CC4=CC=CC=C4)NC(=O)OC(C)(C)C)O