[(5-Chlorobenzo[b]thiophen-3-yl)methyl](triphenyl)phosphonium bromide

Base Information

• Chemical Name: [(5-Chlorobenzo[b]thiophen-3-yl)methyl](triphenyl)phosphonium bromide
• CAS No.: 175203-96-0
• Molecular Formula: C27H21 Cl P S . Br
• Molecular Weight: 523.85
• DSSTox Substance ID: DTXSID80381581
• Mol file: 175203-96-0.mol

Synonyms:175203-96-0;[(5-chlorobenzo[b]thiophen-3-yl)methyl](triphenyl)phosphonium bromide;(5-chloro-1-benzothiophen-3-yl)methyl-triphenylphosphanium;bromide;((5-Chlorobenzo[b]thiophen-3-yl)methyl)triphenylphosphonium bromide;DTXSID80381581;IOZBXXDJAXBEBU-UHFFFAOYSA-M;MFCD00052982;AKOS015908850;FT-0605375;((5-Chlorobenzo[b]thiophen-3-yl)methyl)triphenylphosphoniumbromide;[(5-Chloro-1-benzothiophen-3-yl)methyl](triphenyl)phosphanium bromide

Chemical Property of [(5-Chlorobenzo[b]thiophen-3-yl)methyl](triphenyl)phosphonium bromide

Chemical Property:

• Melting Point: 315 °C
• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 41.83000
• Density: g/cm³
• LogP: 4.05280
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 521.99735
• Heavy Atom Count: 31
• Complexity: 489

Purity/Quality:

98%Min ^*data from raw suppliers

[(5-CHLOROBENZO[B]THIOPHEN-3-YL)METHYL](TRIPHENYL)PHOSPHONIUM BROMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system
• Hazard Codes: Xn:Harmful
• Statements: R20/21/22:Harmful by inhalation, in contact with skin and if swallowed.; R36/37/38:Irritating to eyes, respiratory system
• Safety Statements: S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.; S36/37/39:Wear suitabl

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)[P+](CC2=CSC3=C2C=C(C=C3)Cl)(C4=CC=CC=C4)C5=CC=CC=C5.[Br-]