Bis(triphenylphosphoranylidene)ammonium chloride（PPNCl） - ≥96% , CAS No.21050-13-5

CAS: 21050-13-5 Cat. No.: B102438 Peso molecular: 574.03 Beilstein Registry Number: 4097979 Número EC: 244-170-6

GRADE & PURITY ≥96%

Synonyms

Bis(triphenylphosphoranylidene)ammonium | AKOS015915599 | triphenyl-[(triphenyl-$l^{5}-phosphanylidene)amino]phosphanium chloride | Q172272 | Triphenyl(P,P,P-triphenylphosphine imidato)phosphorus(1+) chloride | A815098 | TRIPHENYL[(TRIPHENYL-??-PHOSPHANYL

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinónimos

Bis(triphenylphosphoranylidene)ammonium | AKOS015915599 | triphenyl-[(triphenyl-$l^{5}-phosphanylidene)amino]phosphanium chloride | Q172272 | Triphenyl(P, P, P-triphenylphosphine imidato)phosphorus(1+) chloride | A815098 | TRIPHENYL[(TRIPHENYL-??-PHOSPHANYL

Especificaciones y pureza

≥96%

Condiciones de almacenamiento de almacenamiento

Argon charged, Room temperature

Enviado en

Normal

Pureza

≥96%

Nombres e identificadores

• Pubchem Sid: 488194225
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488194225
• Sonrisas canónicas: C1=CC=C(C=C1)P(=N[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-]
• IUPAC Name: triphenyl-[(triphenyl-λ5-phosphanylidene)amino]phosphanium;chloride
• InChIKey: LVRCYPYRKNAAMX-UHFFFAOYSA-M
• INCHI: 1S/C36H30NP2.ClH/c1-7-19-31(20-8-1)38(32-21-9-2-10-22-32,33-23-11-3-12-24-33)37-39(34-25-13-4-14-26-34,35-27-15-5-16-28-35)36-29-17-6-18-30-36;/h1-30H;1H/q+1;/p-1
• Isómeros SMILES: C1=CC=C(C=C1)P(=N[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6.[Cl-]
• WGK Alemania: 3
• Peso molecular: 574.03
• Beilstein: 4097979
• Reaxy-Rn: 4097979
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4097979&ln=

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: Organophosphorus compounds Organic nitrogen compounds Organic chloride salts Hydrocarbon derivatives Organic cations
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Triphenylphosphine - Phenylphosphine - Organic nitrogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organophosphorus compound - Organic cation - 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: Moderately soluble in water.
• Sensibilidad: Moisture sensitive
• Punto de fusión (°C): 270-272°C
• Peso molecular: 574.000 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 7
• Exact Mass: 573.154 Da
• Monoisotopic Mass: 573.154 Da
• Topological Polar Surface Area: 12.400 Ų
• Heavy Atom Count: 40
• Formal Charge: 0
• Complexity: 607.000
• 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. Xu Jiang, Faliang Gou, Chenze Qi.  (2018)  C2v-symmetric metalloporphyrin promoted cycloaddition of epoxides with CO2 under atmospheric pressure.  Journal of CO2 Utilization,      [PMID:] [10.1016/j.jcou.2018.12.003]

2. Lan-Fang Hu, Yang Li, Bin Liu, Ying-Ying Zhang, Xing-Hong Zhang.  (2017)  Alternating and regioregular copolymers with high refractive index from COS and biomass-derived epoxides.  RSC Advances,  7  (78): (49490-49497).  [PMID:] [10.1039/C7RA08958A]

3. Xu Jiang, Faliang Gou, Huanwang Jing.  (2014)  Alternating copolymerization of CO2 and propylene oxide catalyzed by C2v-porphyrin cobalt: Selectivity control and a kinetic study.  JOURNAL OF CATALYSIS,      [PMID:] [10.1016/j.jcat.2014.03.008]

4. Gaokuo Du, Huanrong Li, Zixuan Li, Xinchi Ye, Yige Wang.  (2024)  Luminescence Boosting after adding Quaternary ammonium/Phosphine Cations to Europium (III) Laponite Clay.  APPLIED CLAY SCIENCE,      [PMID:] [10.1016/j.clay.2024.107584]

5. Faliang Gou, Wenwen Jiang, Ju Ke, Jingchen Chen, Xu Jiang.  (2024)  Metalloporphyrin catalyzed self-switchable terpolymerization of propene oxide, phthalic anhydride and lactide for one-pot prepare block copolyesters.  POLYMER,      [PMID:] [10.1016/j.polymer.2024.126778]

6. Qingyun Ge, Baihu Dong, Yunqi Chen, Xinqiang Wang, Xiang Wang, Chaogang Fan, Chuhua Chen, Shaohui Lin, Qinmin Pan, Flora T. T. Ng.  (2024)  Salen–cobalt catalyzed degradation of polypropylene carbonate and its application in one-pot tandem synthesis of propylene carbonate.  NEW JOURNAL OF CHEMISTRY,  48  (38): (16836-16843).  [PMID:] [10.1039/D4NJ02996H]

7. Feng Ximin, Liu Xiong, Zhang Xun, Guo Wenqi, Zhang Chengjian, Zhang Xinghong.  (2025)  Air-stable covalent borane–oxyanion organocatalysts for ring-opening copolymerization.  Nature Synthesis,      [PMID:] [10.1038/s44160-025-00923-3]

8. Xinchi Ye, Wei Zhang, Gaokuo Du, Mengmeng Ma, Yige Wang, Huanrong Li.  (2026)  Conferring High Luminescence and Photophysical Stability on a Eu3+ Tetrakis(β-Diketonate) with the Bis(triphenylphosphine)iminium Cation.  INORGANIC CHEMISTRY,      [PMID:] [10.1021/acs.inorgchem.6c00303]