1,3,5-tris(4-aminophenoxy)benzene - ≥97% , CAS No.102852-92-6

CAS: 102852-92-6 Cat. No.: B299730 Peso molecular: 399.45 Número EC: 878-922-5

GRADE & PURITY ≥97%

Synonyms

SB83725 | CS0010 | CEA85292 | FT-0775097 | Benzenamine, 4,4',4''-[1,3,5-benzenetriyltris(oxy)]tris- | AKOS005266414 | 1,3,5-TRIS(4-AMINOPHENOXY)BENZENE (135TAPOB) | AS-66460 | 4,4',4''-(Benzene-1,3,5-triyltris(oxy))trianiline | J-000822 | 4-[3,5-bis(4-ami

Storage

Protected from light,Room temperature,Argon charged,Desiccated,Cool

Shipped In

Normal

Specifications

Sinónimos

SB83725 | CS0010 | CEA85292 | FT-0775097 | Benzenamine, 4, 4', 4''-[1, 3, 5-benzenetriyltris(oxy)]tris- | AKOS005266414 | 1, 3, 5-TRIS(4-AMINOPHENOXY)BENZENE (135TAPOB) | AS-66460 | 4, 4', 4''-(Benzene-1, 3, 5-triyltris(oxy))trianiline | J-000822 | 4-[3, 5-bis(4-ami

Especificaciones y pureza

≥97%

Condiciones de almacenamiento de almacenamiento

Protected from light, Room temperature, Argon charged, Desiccated, Cool

Enviado en

Normal

Pureza

≥97%

Nombres e identificadores

• Pubchem Sid: 488199866
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488199866
• Sonrisas canónicas: C1=CC(=CC=C1N)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)N)OC4=CC=C(C=C4)N
• IUPAC Name: 4-[3,5-bis(4-aminophenoxy)phenoxy]aniline
• InChIKey: PAPDRIKTCIYHFI-UHFFFAOYSA-N
• INCHI: 1S/C24H21N3O3/c25-16-1-7-19(8-2-16)28-22-13-23(29-20-9-3-17(26)4-10-20)15-24(14-22)30-21-11-5-18(27)6-12-21/h1-15H,25-27H2
• Isómeros SMILES: C1=CC(=CC=C1N)OC2=CC(=CC(=C2)OC3=CC=C(C=C3)N)OC4=CC=C(C=C4)N
• Peso molecular: 399.45
• Reaxy-Rn: 10292248
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=10292248&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Clase: Benzene and substituted derivatives
• Subclass: Diphenylethers
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylethers
• Alternative Parents: Diarylethers Phenoxy compounds Phenol ethers Aniline and substituted anilines Primary amines Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylether - Diaryl ether - Phenoxy compound - Aniline or substituted anilines - Phenol ether - Ether - Organic nitrogen compound - Organic oxygen compound - Hydrocarbon derivative - Primary amine - Organooxygen compound - Organonitrogen compound - Amine - Aromatic homomonocyclic compound
• Descripción: This compound belongs to the class of organic compounds known as diphenylethers. These are aromatic compounds containing two benzene rings linked to each other through an ether 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

• Sensibilidad: Air sensitive；light sensitive
• Punto de fusión (°C): 151 °C
• Peso molecular: 399.400 g/mol
• XLogP3: 3.700
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 399.158 Da
• Monoisotopic Mass: 399.158 Da
• Topological Polar Surface Area: 106.000 Ų
• Heavy Atom Count: 30
• Formal Charge: 0
• Complexity: 415.000
• 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. Lu Zhao, Junyong Chen, Defang Pan, Yan Hou.  (2023)  Robust, Fire-Retardant, and Water-Resistant Wood/Polyimide Composite Aerogels with a Hierarchical Pore Structure for Thermal Insulation.  Gels,  9  (6): (467).  [PMID:37367138] [10.3390/gels9060467]

2. He Huang, Can Wu, Shiqi Wu, Ruiqun Pan, Lianhua Yin, Xiangyu Jin, Yiwu Pan, Hebing Wang, Xiaojie Yan, Changqing Hong, Wenbo Han, Xinghong Zhang.  (2022)  Super-flexible, thermostable and superhydrophobic polyimide/silicone interpenetrating aerogels for conformal thermal insulating and strain sensing applications.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2022.136032]

3. Dandan Li, Man He, Beibei Chen, Bin Hu.  (2019)  Magnetic porous organic polymers for magnetic solid-phase extraction of triazole fungicides in vegetables prior to their determination by gas chromatography-flame ionization detection.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:31130223] [10.1016/j.chroma.2019.04.062]

4. Yuwei Chen, Yidong Liu, Yonggang Min.  (2025)  Enhanced Mechanical and Thermal Performance of Crosslinked Polyimides: Insights from Molecular Dynamics Simulations and Experimental Characterization for Motor Insulation Applications.  POLYMER TESTING,      [PMID:] [10.1016/j.polymertesting.2025.108705]

5. Junyong Chen, Defang Pan.  (2025)  Robust and Hydrophobic Silica/Polyimide Aerogel with Pomegranate-like Structure for Thermal Insulation and Flame Retardancy up to 1300 °C.  MOLECULES,  30  (8): (1709).  [PMID:40333591] [10.3390/molecules30081709]