4-Tritylaniline - ≥97% , CAS No.22948-06-7

CAS: 22948-06-7 Cat. No.: T168801 Fórmula: C₂₅H₂₁N Peso molecular: 335.44 Número CE: 245-346-5 PubChem CID: 89914

GRADE & PURITY ≥97%

Synonyms

4-Aminotetraphenylmethan | DTXSID8066844 | Triphenylmethyl-containing compound, 19 | 3-Piperidine-4-yl-propionic acid | MFCD00007898 | p-Toluidine, alpha,alpha,alpha-triphenyl- | 4-pyrrolidinocarbonylpiperidine | 4-Aminotetraphenylmethane | Benzenamine,4-

Storage

Room temperature,Argon charged

Shipped In

Normal

Visão geral

4-Tritylaniline was used in the preparation of:
• 5-tritylisatin
• 2,7-di-tert-butyl-9,9-dimethyl-4,5-bis(4-tritylanilinocarbonyl)-9H-xanthene methanol trisolvate monohydrate
• bis-4,4-[6-chloro-N-(4-tritylphenyl)-[1,3,5]triazine-2,4-diamine]-[2,2-disulfonic acid]-stilbene, novel fluorophore, with potential application as an optical brightener

Specifications

Sinónimos

4-Aminotetraphenylmethan | DTXSID8066844 | Triphenylmethyl-containing compound, 19 | 3-Piperidine-4-yl-propionic acid | MFCD00007898 | p-Toluidine, alpha,alpha,alpha-triphenyl- | 4-pyrrolidinocarbonylpiperidine | 4-Aminotetraphenylmethane | Benzenamine,4-

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥97%

Nomes e identificadores

• Pubchem Sid: 488186579
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488186579
• Sorrisos canónicos: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)N
• IUPAC Name: 4-tritylaniline
• InChIKey: XYHDHXBLSLSXSR-UHFFFAOYSA-N
• INCHI: 1S/C25H21N/c26-24-18-16-23(17-19-24)25(20-10-4-1-5-11-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-19H,26H2
• SMILES isoméricas: C1=CC=C(C=C1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=C(C=C4)N
• WGK Alemanha: 3
• RTECS: CY1220000
• PubChem CID: 89914
• Peso molecular: 335.44

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Classe Benzene and substituted derivatives
      • Subclass Aniline and substituted anilines

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Aniline and substituted anilines
• Intermediate Tree Nodes: Not available
• Direct Parent: Aniline and substituted anilines
• Alternative Parents: Primary amines Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Aniline or substituted anilines - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as aniline and substituted anilines. These are organic compounds containing an aminobenzene moiety.
• 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

Mecanismos de ação

Propriedades químicas e físicas

• Ponto de fusão (°C): 255-257 °C
• Peso molecular: 335.400 g/mol
• XLogP3: 6.300
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 335.167 Da
• Monoisotopic Mass: 335.167 Da
• Topological Polar Surface Area: 26.000 Ų
• Heavy Atom Count: 26
• Formal Charge: 0
• Complexity: 358.000
• 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