4,6-Bis(difenilfosfino)dibenzofurano - ≥98% , CAS No.133850-81-4

CAS: 133850-81-4 Cat. No.: B281844 Peso molecular: 536.54 Número EC: 814-447-1

GRADE & PURITY ≥98%

Synonyms

AKOS015909980 | Phosphine, 4,6-dibenzofurandiylbis[diphenyl- | MFCD00233867 | 4,6-Bis(diphenylphosphino) dibenzofuran | (6-diphenylphosphanyldibenzofuran-4-yl)-diphenylphosphane | VAVXLUZIWOAKCD-UHFFFAOYSA-N | SCHEMBL2288606 | E75437 | [6-(Diphenylphosphi

Storage

Conservar a 2-8°C,cargado con argón

Shipped In

Hielo húmedo

Specifications

Sinónimos

AKOS015909980 | Phosphine, 4, 6-dibenzofurandiylbis[diphenyl- | MFCD00233867 | 4, 6-Bis(diphenylphosphino) dibenzofuran | (6-diphenylphosphanyldibenzofuran-4-yl)-diphenylphosphane | VAVXLUZIWOAKCD-UHFFFAOYSA-N | SCHEMBL2288606 | E75437 | [6-(Diphenylphosphi

Especificaciones y pureza

≥98%

Condiciones de almacenamiento de almacenamiento

Conservar a 2-8°C, cargado con argón

Enviado en

Hielo húmedo

Pureza

≥98%

Nombres e identificadores

• Sonrisas canónicas: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC4=C3OC5=C4C=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7
• IUPAC Name: (6-diphenylphosphanyldibenzofuran-4-yl)-diphenylphosphane
• InChIKey: VAVXLUZIWOAKCD-UHFFFAOYSA-N
• INCHI: 1S/C36H26OP2/c1-5-15-27(16-6-1)38(28-17-7-2-8-18-28)33-25-13-23-31-32-24-14-26-34(36(32)37-35(31)33)39(29-19-9-3-10-20-29)30-21-11-4-12-22-30/h1-26H
• Isómeros SMILES: C1=CC=C(C=C1)P(C2=CC=CC=C2)C3=CC=CC4=C3OC5=C4C=CC=C5P(C6=CC=CC=C6)C7=CC=CC=C7
• Peso molecular: 536.54
• Reaxy-Rn: 4829420
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4829420&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: Dibenzofurans Heteroaromatic compounds Furans Organic phosphines and derivatives Oxacyclic compounds Organopnictogen compounds Organooxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteropolycyclic compounds
• Substituents: Triphenylphosphine - Dibenzofuran - Benzofuran - Phenylphosphine - Heteroaromatic compound - Furan - Phosphine - Oxacycle - Organoheterocyclic compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organophosphorus compound - Organooxygen compound - Aromatic heteropolycyclic 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

• Peso molecular: 536.500 g/mol
• XLogP3: 9.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 6
• Exact Mass: 536.146 Da
• Monoisotopic Mass: 536.146 Da
• Topological Polar Surface Area: 13.100 Ų
• Heavy Atom Count: 39
• Formal Charge: 0
• Complexity: 649.000
• 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: 1

Referencias

1. Zhang Dingshuo, Zhu Meiyi, He Yifan, Cao Qingli, Gao Yun, Li Hongjin, Lu Guochao, Cui Qiaopeng, Shen Yongmiao, He Haiping, Dai Xingliang, Ye Zhizhen.  (2024)  Efficient and bright broadband electroluminescence based on environment-friendly metal halide nanoclusters.  Light-Science & Applications,  13  (1): (1-11).  [PMID:38584197] [10.1038/s41377-024-01427-z]