Ethyltriphenylphosphonium iodide - ≥95% , CAS No.4736-60-1

CAS: 4736-60-1 Cat. No.: E107825 Peso molecular: 418.25 Beilstein Registry Number: 3659323 Número EC: 225-245-2 PubChem CID: 78474

GRADE & PURITY ≥95%

Synonyms

ETPPI | N-(2-Pyridylmethyl)aniline | XXZ2V239JN | SCHEMBL41863 | ethyltriphenyl phosphonium iodide | MFCD00001519 | Ethyltriphenylphosphonium iodide | Ethyltriphenylphosphonium iodide, 95% | ethyltriphenylphosphanium iodide | D90540 | Triphenylethylphosph

Storage

Argon charged,Room temperature

Shipped In

Normal

Descripción general

application：

Ethyltriphenylphosphonium iodide is involved in synthesis of diarylmethine derivatives, phosphonium salts, and bismuth(III) polynuclear halide complexes, asymmetric hydrogenation.

Specifications

Sinónimos

ETPPI | N-(2-Pyridylmethyl)aniline | XXZ2V239JN | SCHEMBL41863 | ethyltriphenyl phosphonium iodide | MFCD00001519 | Ethyltriphenylphosphonium iodide | Ethyltriphenylphosphonium iodide, 95% | ethyltriphenylphosphanium iodide | D90540 | Triphenylethylphosph

Especificaciones y pureza

≥95%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥95%

Nombres e identificadores

• Pubchem Sid: 488185582
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488185582
• Sonrisas canónicas: CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]
• IUPAC Name: ethyl(triphenyl)phosphanium;iodide
• InChIKey: SLAFUPJSGFVWPP-UHFFFAOYSA-M
• INCHI: 1S/C20H20P.HI/c1-2-21(18-12-6-3-7-13-18,19-14-8-4-9-15-19)20-16-10-5-11-17-20;/h3-17H,2H2,1H3;1H/q+1;/p-1
• Isómeros SMILES: CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[I-]
• WGK Alemania: 3
• RTECS: TA2312000
• PubChem CID: 78474
• Peso molecular: 418.25
• Beilstein: 3659323
• Reaxy-Rn: 3659323

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Clase Benzene and substituted derivatives
      • Subclass Phenylphosphines and derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Phenylphosphines and derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Phenylphosphines and derivatives
• Alternative Parents: Organopnictogen compounds Organophosphorus compounds Organic iodide salts Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Triphenylphosphine - Phenylphosphine - Organopnictogen compound - Hydrocarbon derivative - Organic iodide salt - Organic salt - Organophosphorus compound - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as phenylphosphines and derivatives. These are compounds containing a phenylphosphine, which consists of phosphine substituent bound to a phenyl group.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propiedades químicas y físicas

• Solubilidad: Soluble in water and methanol.
• Sensibilidad: Light sensitive ,Moisture sensitive
• Punto de fusión (°C): 168°C-172°C
• Peso molecular: 418.200 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 418.035 Da
• Monoisotopic Mass: 418.035 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 247.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Referencias

1. Zhou Ren, Yang Liu, Yuan Lyu, Xiangen Song, Changyong Zheng, Zheng Jiang, Yunjie Ding.  (2020)  Quaternary phosphonium polymer-supported dual-ionically bound [Rh(CO)I3]2– catalyst for heterogeneous ethanol carbonylation.  CHINESE JOURNAL OF CATALYSIS,      [PMID:] [10.1016/S1872-2067(20)63676-2]