(-)-Devapamil

Base Information

• Chemical Name: (-)-Devapamil
• CAS No.: 93468-87-2
• Molecular Formula: C26H36N2O3
• Molecular Weight: 424.5756
• UNII: 99EAI85506
• DSSTox Substance ID: DTXSID401109924
• Wikidata: Q27077027
• Pharos Ligand ID: HPX6C8P3KGM3
• Mol file: 93468-87-2.mol

Synonyms:(-)-H3-desmethoxyverapamil;4-desmethoxyverapamil;4-DMV;D 888;D-888;D888

Chemical Property of (-)-Devapamil

Chemical Property:

• Vapor Pressure: 7.14E-13mmHg at 25°C
• Boiling Point: 567°Cat760mmHg
• Flash Point: 296.7°C
• PSA: 54.72000
• Density: 1.047g/cm³
• LogP: 5.08448
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 12
• Exact Mass: 424.27259301
• Heavy Atom Count: 31
• Complexity: 560

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: CC(C)C(CCCN(C)CCC1=CC(=CC=C1)OC)(C#N)C2=CC(=C(C=C2)OC)OC
• Isomeric SMILES: CC(C)[C@](CCCN(C)CCC1=CC(=CC=C1)OC)(C#N)C2=CC(=C(C=C2)OC)OC