2-Propenoic acid, 3-(2,4-dichlorophenyl)-, 2-(3,4-dichlorophenyl)-4-(hexahydro-1H-azepin-1-yl)butyl ester, hydrochloride

Base Information

• Chemical Name: 2-Propenoic acid, 3-(2,4-dichlorophenyl)-, 2-(3,4-dichlorophenyl)-4-(hexahydro-1H-azepin-1-yl)butyl ester, hydrochloride
• CAS No.: 119585-13-6
• Molecular Formula: C25H27 Cl4 N O2 . Cl H
• Molecular Weight: 551.7603
• Mol file: 119585-13-6.mol

Synonyms:SR 44431 A;2-Propenoic acid, 3-(2,4-dichlorophenyl)-, 2-(3,4-dichlorophenyl)-4-(hexahydro-1H-azepin-1-yl)butyl ester, hydrochloride;119585-13-6;C25H27Cl4NO2.ClH;C25-H27-Cl4-N-O2.Cl-H;LS-123620

Chemical Property of 2-Propenoic acid, 3-(2,4-dichlorophenyl)-, 2-(3,4-dichlorophenyl)-4-(hexahydro-1H-azepin-1-yl)butyl ester, hydrochloride

Chemical Property:

• Vapor Pressure: 6.76E-15mmHg at 25°C
• Boiling Point: 611.6°Cat760mmHg
• Flash Point: 323.7°C
• Density: g/cm³
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 9
• Exact Mass: 551.053317
• Heavy Atom Count: 33
• Complexity: 597

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCCN(CC1)CCC(COC(=O)C=CC2=C(C=C(C=C2)Cl)Cl)C3=CC(=C(C=C3)Cl)Cl.Cl
• Isomeric SMILES: C1CCCN(CC1)CCC(COC(=O)/C=C/C2=C(C=C(C=C2)Cl)Cl)C3=CC(=C(C=C3)Cl)Cl.Cl