Benzoic acid, 2,4-dichloro-, 5-(2-(phenylmethoxy)cyclohexyl)-2-pentenyl ester, (1alpha(E),2beta)-

Base Information

• Chemical Name: Benzoic acid, 2,4-dichloro-, 5-(2-(phenylmethoxy)cyclohexyl)-2-pentenyl ester, (1alpha(E),2beta)-
• CAS No.: 101859-44-3
• Molecular Formula: C₂₅H₂₈Cl₂O₃
• Molecular Weight: 447.402
• Mol file: 101859-44-3.mol

Synonyms:101859-44-3;Benzoic acid, 2,4-dichloro-, 5-(2-(phenylmethoxy)cyclohexyl)-2-pentenyl ester, (1alpha(E),2beta)-

Chemical Property of Benzoic acid, 2,4-dichloro-, 5-(2-(phenylmethoxy)cyclohexyl)-2-pentenyl ester, (1alpha(E),2beta)-

Chemical Property:

• Vapor Pressure: 5.48E-12mmHg at 25°C
• Boiling Point: 546.2°Cat760mmHg
• Flash Point: 175.2°C
• Density: 1.21g/cm³
• XLogP3: 7.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 10
• Exact Mass: 446.1415501
• Heavy Atom Count: 30
• Complexity: 533

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCC(C(C1)CCC=CCOC(=O)C2=C(C=C(C=C2)Cl)Cl)OCC3=CC=CC=C3
• Isomeric SMILES: C1CC[C@@H]([C@H](C1)CC/C=C/COC(=O)C2=C(C=C(C=C2)Cl)Cl)OCC3=CC=CC=C3