Butyltriphenylphosphonium bromide

• CAS: 1779-51-7
• Catalog Number: ACM1779517-3
• Category: Bromine Series
• Molecular Weight: 399.3
• Molecular Formula: C22H24BrP
• Synonyms: (1-Butyl)triphenylphosphonium bromide
• IUPAC Name: butyl(triphenyl)phosphanium;bromide
• Canonical SMILES: CCCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]
• InChI: InChI=1S/C22H24P.BrH/c1-2-3-19-23(20-13-7-4-8-14-20,21-15-9-5-10-16-21)22-17-11-6-12-18-22;/h4-18H,2-3,19H2,1H3;1H/q+1;/p-1
• InChI Key: IKWKJIWDLVYZIY-UHFFFAOYSA-M
• Melting Point: 240-243 °C
• Solubility: Soluble in chloroform and methanol
• Appearance: White crystalline powder
• Application: Reactant for: Free radical 5-exo-dig cyclization Intramolecular hydroacylalkoxylation Wittig reactions for stereoselective synthesis of alkenes Dimerization of α-olefins Alkylidenation of hydrazides for synthesis of indoles Tandem cyclization and 1,2-thiolate shift of nitrogen ylides
• Storage: Inert atmosphere, Room Temperature
• Complexity: 273
• Covalently-Bonded Unit Count: 2
• EC Number: 918-205-7
• Exact Mass: 398.0799
• H-Bond Acceptor: 1
• Heavy Atom Count: 24
• Monoisotopic Mass: 398.0799
• NSC Number: 59684
• Rotatable Bond Count: 6
• Topological Polar Surface Area: 0 Ų