Democonazole

Base Information

• Chemical Name: Democonazole
• CAS No.: 70161-09-0
• Molecular Formula: C19H15Cl3N2O2
• Molecular Weight: 409.698
• UNII: 2Z4E7E087J
• DSSTox Substance ID: DTXSID201024469
• Wikidata: Q27255829
• NCI Thesaurus Code: C78038
• Mol file: 70161-09-0.mol

Synonyms:1-(2,4-dichloro-beta-(2-(4-chlorophenoxy)ethoxy)styryl)imidazole;democonazole

Chemical Property of Democonazole

Chemical Property:

• Vapor Pressure: 5.37E-13mmHg at 25°C
• Boiling Point: 569.8°C at 760 mmHg
• Flash Point: 298.4°C
• PSA: 36.28000
• Density: 1.32g/cm³
• LogP: 5.89450
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 408.019911
• Heavy Atom Count: 26
• Complexity: 458

Purity/Quality:

DEMOCONAZOLE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1OCCOC(=CN2C=CN=C2)C3=C(C=C(C=C3)Cl)Cl)Cl
• Isomeric SMILES: C1=CC(=CC=C1OCCO/C(=C/N2C=CN=C2)/C3=C(C=C(C=C3)Cl)Cl)Cl