2-(4-Bromophenyl)-2-oxoethyl 4-(phenylethynyl)benzoate

Base Information

• Chemical Name: 2-(4-Bromophenyl)-2-oxoethyl 4-(phenylethynyl)benzoate
• CAS No.: 5858-99-1
• Molecular Formula: C23H15BrO3
• Molecular Weight: 419.2674
• DSSTox Substance ID: DTXSID70366862
• Wikidata: Q82152307
• Mol file: 5858-99-1.mol

Synonyms:STK136555;2-(4-bromophenyl)-2-oxoethyl 4-(phenylethynyl)benzoate;5858-99-1;CBMicro_035679;DTXSID70366862;AKOS005404324;BIM-0035725.P001;2-Naphthalenesulfonic acid, 5-[[2-(4,6-dimethyl-2-benzothiazolyl)-4-methylphenyl]azo]-6-hydroxy-, monosodium salt;2-Naphthalenesulfonic acid, 5-[[2-(4,6-dimethyl-2-benzothiazolyl)-p-tolyl]azo]-6-hydroxy-, monosodium salt

Chemical Property of 2-(4-Bromophenyl)-2-oxoethyl 4-(phenylethynyl)benzoate

Chemical Property:

• Vapor Pressure: 6.52E-14mmHg at 25°C
• Boiling Point: 590.3°C at 760 mmHg
• Flash Point: 310.8°C
• Density: 1.45g/cm³
• XLogP3: 5.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 418.02046
• Heavy Atom Count: 27
• Complexity: 565

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C#CC2=CC=C(C=C2)C(=O)OCC(=O)C3=CC=C(C=C3)Br