1-(4-sec-Butyl-phenyl)-2-chloro-ethanone

Base Information

• Chemical Name: 1-(4-sec-Butyl-phenyl)-2-chloro-ethanone
• CAS No.: 77234-66-3
• Molecular Formula: C12H15ClO
• Molecular Weight: 210.6999
• Hs Code.: 2914700090
• DSSTox Substance ID: DTXSID90403521
• Mol file: 77234-66-3.mol

Synonyms:77234-66-3;1-(4-sec-Butyl-phenyl)-2-chloro-ethanone;1-(4-butan-2-ylphenyl)-2-chloroethanone;1-[4-(butan-2-yl)phenyl]-2-chloroethan-1-one;1-(4-(sec-Butyl)phenyl)-2-chloroethanone;Ethanone,2-chloro-1-[4-(1-methylpropyl)phenyl]-(9ci);THIPHYDROCHLORIDE;DTXSID90403521;CDA23466;AKOS000115661;AKOS016880158;EN300-01983;Z56891222

Chemical Property of 1-(4-sec-Butyl-phenyl)-2-chloro-ethanone

Chemical Property:

• Vapor Pressure: 0.000516mmHg at 25°C
• Boiling Point: 312.8°C at 760 mmHg
• Flash Point: 175.1°C
• PSA: 17.07000
• Density: 1.059g/cm³
• LogP: 3.62160
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 210.0811428
• Heavy Atom Count: 14
• Complexity: 183

Purity/Quality:

1-[4-(butan-2-yl)phenyl]-2-chloroethan-1-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCC(C)C1=CC=C(C=C1)C(=O)CCl