(E)-1-(3,5-dichloro-2-hydroxyphenyl)non-1-en-3-one

Base Information

• Chemical Name: (E)-1-(3,5-dichloro-2-hydroxyphenyl)non-1-en-3-one
• CAS No.: 72570-86-6
• Molecular Formula: C15H18Cl2O2
• Molecular Weight: 301.2082
• NSC Number: 295664
• DSSTox Substance ID: DTXSID40421194
• Wikidata: Q82232587
• Mol file: 72570-86-6.mol

Synonyms:NSC295664;72570-86-6;DTXSID40421194;NSC-295664

Chemical Property of (E)-1-(3,5-dichloro-2-hydroxyphenyl)non-1-en-3-one

Chemical Property:

• Vapor Pressure: 5.18E-08mmHg at 25°C
• Boiling Point: 430.4°C at 760 mmHg
• Flash Point: 214.1°C
• Density: 1.21g/cm³
• XLogP3: 5.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 300.0683852
• Heavy Atom Count: 19
• Complexity: 305

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(=O)C=CC1=C(C(=CC(=C1)Cl)Cl)O
• Isomeric SMILES: CCCCCCC(=O)/C=C/C1=C(C(=CC(=C1)Cl)Cl)O