Phosphazene base P2-t-Bu solution - ~2.0 M in THF , CAS No.111324-03-9

CAS: 111324-03-9 Cat. No.: P353098 Summenformel: C₁₄H₃₉N₇P₂ Molekulargewicht: 367.45 EG-Nummer: 627-896-1 PubChem CID: 4275357

GRADE & PURITY ~2.0 M in THF

Synonyms

J-002559 | CJTQESMNKMUZAO-UHFFFAOYSA-N | 1-tert-Butyl-2,2,4,4,4-pentakis(dimethylamino)-2-lambda5,-4lambda5-catenadi(phosphazene) | 1-tert-Butyl-2,2,4,4,4-pentakis(dimethylamino)-2Lambda5,4Lambda5-catenadi(phosphazene) | AKOS015894796 | DTXSID30401465 | S

Storage

Room temperature,Argon charged

Shipped In

Normal

Übersicht

Extremely strong and hindered neutral nitrogen base; approximately 109 times more basic than DBU [pKa (DMSO) 21.45]. Stable to hydrolysis and unaffected by alkylating agents. Highly selective base. Deprotonation of phosphines.

Specifications

Synonyme

J-002559 | CJTQESMNKMUZAO-UHFFFAOYSA-N | 1-tert-Butyl-2,2,4,4,4-pentakis(dimethylamino)-2-lambda5,-4lambda5-catenadi(phosphazene) | 1-tert-Butyl-2,2,4,4,4-pentakis(dimethylamino)-2Lambda5,4Lambda5-catenadi(phosphazene) | AKOS015894796 | DTXSID30401465 | S

Spezifikationen & Reinheit

~2.0 M in THF

Storage

Room temperature,Argon charged

Verschickt in

Normal

Namen und Kennungen

• Pubchem Sid: 504762942
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504762942
• Kanonisches Lächeln: CC(C)(C)N=P(N=P(N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C
• IUPAC Name: N-[tert-butylimino-(dimethylamino)-[[tris(dimethylamino)-λ5-phosphanylidene]amino]-λ5-phosphanyl]-N-methylmethanamine
• InChIKey: CJTQESMNKMUZAO-UHFFFAOYSA-N
• INCHI: 1S/C14H39N7P2/c1-14(2,3)15-22(17(4)5,18(6)7)16-23(19(8)9,20(10)11)21(12)13/h1-13H3
• Isomere SMILES: CC(C)(C)N=P(N=P(N(C)C)(N(C)C)N(C)C)(N(C)C)N(C)C
• WGK Deutschland: 3
• PubChem CID: 4275357
• UN-Nummer: 2920
• Verpackungsgruppe: I
• Molekulargewicht: 367.45

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Klasse Organonitrogen compounds

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Klasse: Organonitrogen compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Organonitrogen compounds
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Organonitrogen compound - Aliphatic acyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as organonitrogen compounds. These are organic compounds containing a nitrogen atom.
• 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

Chemische und physikalische Eigenschaften

• Flammpunkt (°F): 1.4 °F
• Flammpunkt (°C): -17 °C
• Siedepunkt (°C): 66° C
• Molekulargewicht: 367.450 g/mol
• XLogP3: 2.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 367.274 Da
• Monoisotopic Mass: 367.274 Da
• Topological Polar Surface Area: 40.900 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 447.000
• 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

Referenzen

1. Lijuan Deng, Wenshan Guo, Huu Hao Ngo, Xinbo Zhang, Dong Wei, Qin Wei, Shihai Deng.  (2023)  Novel catalysts in catalytic upcycling of common polymer wastes.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2023.144350]