Cas no 6048-29-9 (Phenacyltriphenylphosphonium bromide)

Phenacyltriphenylphosphonium bromide is a phosphonium salt widely utilized in organic synthesis, particularly in the formation of ylides for Wittig reactions. Its key advantages include high reactivity as a precursor to stabilized ylides, enabling the efficient synthesis of alkenes from carbonyl compounds. The compound exhibits excellent stability under standard conditions, facilitating handling and storage. Its crystalline form ensures consistent purity, making it suitable for precise stoichiometric applications. Additionally, Phenacyltriphenylphosphonium bromide is often employed in the preparation of conjugated systems and heterocyclic compounds, underscoring its versatility in synthetic chemistry. The product’s reliability and well-documented reactivity profile make it a valuable reagent in academic and industrial research.
Phenacyltriphenylphosphonium bromide structure
6048-29-9 structure
Product Name:Phenacyltriphenylphosphonium bromide
CAS No:6048-29-9
MF:C26H22BrOP
MW:461.330047130585
MDL:MFCD00011920
CID:85523
PubChem ID:24849116
Update Time:2025-06-08

Phenacyltriphenylphosphonium bromide Chemical and Physical Properties

Names and Identifiers

    • (2-Oxo-2-phenylethyl)triphenylphosphonium bromide
    • Phenacyltriphenylphosphonium Bromide
    • phenacyl(triphenyl)phosphanium,bromide
    • (Benzoylmethyl)triphenylphosphonium bromide
    • Triphenylphenacylphosphonium bromide
    • Phosphonium, phenacyltriphenyl-, bromide
    • Phenacyltriphenylphosphoniumbromide
    • Phosphonium, (2-oxo-2-phenylethyl)triphenyl-, bromide
    • phenacyl(triphenyl)phosphanium bromide
    • C26H22BrOP
    • WLN: RV1PR&R&R &E
    • AEHDSYHVTDJGDN-UHFFFAOYSA-M
    • AM1093
    • 9019AB
    • phenacyl(tripheny
    • D92085
    • MFCD00011920
    • EINECS 227-945-3
    • P1182
    • (2-Oxo-2-phenylethyl)triphenylphosphoniumbromide
    • AKOS001064827
    • UNII-7Q4EJF9TR6
    • SY103674
    • Phosphonium, (2-oxo-2-phenylethyl)triphenyl-, bromide (1:1)
    • phenacyl(triphenyl)phosphanium;bromide
    • SCHEMBL1045115
    • NSC 6743
    • Z57079474
    • Benzoylmethyl)triphenylphosphonium bromide
    • FT-0635954
    • DTXSID40975889
    • 6048-29-9
    • 7Q4EJF9TR6
    • Methyl4-tert-butylphenylacetate
    • NSC-6743
    • A832751
    • NS00044888
    • (2-Oxo-2-phenylethyl)(triphenyl)phosphanium bromide
    • Benzoylmethyltriphenylphosphonium bromide
    • DB-053628
    • (2-oxo-2-phenylethyl)triphenylphosphanium bromide
    • Phenacyltriphenylphosphonium bromide
    • MDL: MFCD00011920
    • Inchi: 1S/C26H22OP.BrH/c27-26(22-13-5-1-6-14-22)21-28(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;/h1-20H,21H2;1H/q+1;/p-1
    • InChI Key: AEHDSYHVTDJGDN-UHFFFAOYSA-M
    • SMILES: [Br-].[P+](C1C=CC=CC=1)(C1C=CC=CC=1)(C1C=CC=CC=1)CC(C1C=CC=CC=1)=O
    • BRN: 3642554

Computed Properties

  • Exact Mass: 460.05900
  • Monoisotopic Mass: 460.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 29
  • Rotatable Bond Count: 6
  • Complexity: 431
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Surface Charge: 0
  • Tautomer Count: 2
  • XLogP3: nothing
  • Topological Polar Surface Area: 17.1

Experimental Properties

  • Color/Form: Not determined
  • Melting Point: 265-268?°C (dec.) (lit.)
  • PSA: 30.66000
  • LogP: 1.86740
  • Sensitiveness: Hygroscopic
  • Solubility: Not determined

Phenacyltriphenylphosphonium bromide Security Information

  • Symbol: GHS07
  • Prompt:warning
  • Signal Word:Warning
  • Hazard Statement: H315,H319,H335
  • Warning Statement: P261,P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26-S37/39
  • RTECS:TA2400000
  • Hazardous Material Identification: Xi
  • Safety Term:S24/25
  • Risk Phrases:R36/37/38

Phenacyltriphenylphosphonium bromide Pricemore >>

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