O-(alpha-(Benzoylamino)-4-(phenylazo)cinnamoyl)-beta-phenyllactate

Base Information

• Chemical Name: O-(alpha-(Benzoylamino)-4-(phenylazo)cinnamoyl)-beta-phenyllactate
• CAS No.: 133658-51-2
• Molecular Formula: C31H25 N3 O5
• Molecular Weight: 519.55
• Mol file: 133658-51-2.mol

Synonyms:BAPACPL;O-(alpha-(benzoylamino)-4-(phenylazo)cinnamoyl)-beta-phenyllactate

Chemical Property of O-(alpha-(Benzoylamino)-4-(phenylazo)cinnamoyl)-beta-phenyllactate

Chemical Property:

• Vapor Pressure: 2.41E-26mmHg at 25°C
• Boiling Point: 790.6°Cat760mmHg
• Flash Point: 431.9°C
• PSA: 120.91000
• Density: 1.21g/cm³
• LogP: 6.68680
• XLogP3: 6.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 11
• Exact Mass: 519.17942091
• Heavy Atom Count: 39
• Complexity: 862

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC(C(=O)O)OC(=O)C(=CC2=CC=C(C=C2)N=NC3=CC=CC=C3)NC(=O)C4=CC=CC=C4
• Isomeric SMILES: C1=CC=C(C=C1)C[C@@H](C(=O)O)OC(=O)/C(=C\C2=CC=C(C=C2)N=NC3=CC=CC=C3)/NC(=O)C4=CC=CC=C4