2,2-Bis(4-aminophenyl)hexafluoropropane - ≥98% , CAS No.1095-78-9

CAS: 1095-78-9 Cat. No.: B399480 Fórmula: C₁₅H₁₂F₆N₂ Peso molecular: 334.27 Número CE: 600-922-9

GRADE & PURITY ≥98%

Synonyms

1095-78-9|2,2-Bis(4-aminophenyl)hexafluoropropane|4,4'-(Perfluoropropane-2,2-diyl)dianiline|4,4'-(Hexafluoroisopropylidene)dianiline|4-[2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]aniline|Benzenamine, 4,4'-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Sinónimos

1095-78-9 | 2,2-Bis(4-aminophenyl)hexafluoropropane | 4,4'-(Perfluoropropane-2,2-diyl)dianiline | 4,4'-(Hexafluoroisopropylidene)dianiline | 4-[2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]aniline | Benzenamine, 4,4'-[2,2,2-trifluoro-1-(trifluoromethyl)ethyl

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature,Argon charged

Enviado em

Normal

Pureza

≥98%

Propriedades do produto

• pKa: 3.98±0.25(Predicted)

Nomes e identificadores

• Pubchem Sid: 504759576
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504759576
• Sorrisos canónicos: C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C(F)(F)F)C(F)(F)F)N
• IUPAC Name: 4-[2-(4-aminophenyl)-1,1,1,3,3,3-hexafluoropropan-2-yl]aniline
• InChIKey: BEKFRNOZJSYWKZ-UHFFFAOYSA-N
• INCHI: 1S/C15H12F6N2/c16-14(17,18)13(15(19,20)21,9-1-5-11(22)6-2-9)10-3-7-12(23)8-4-10/h1-8H,22-23H2
• SMILES isoméricas: C1=CC(=CC=C1C(C2=CC=C(C=C2)N)(C(F)(F)F)C(F)(F)F)N
• WGK Alemanha: 3
• Peso molecular: 334.27
• Reaxy-Rn: 2163816
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2163816&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Diphenylmethanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Diphenylmethanes
• Alternative Parents: Aniline and substituted anilines Primary amines Organopnictogen compounds Organofluorides Hydrocarbon derivatives Alkyl fluorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Aniline or substituted anilines - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Organofluoride - Organohalogen compound - Amine - Alkyl halide - Alkyl fluoride - Aromatic homomonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as diphenylmethanes. These are compounds containing a diphenylmethane moiety, which consists of a methane wherein two hydrogen atoms are replaced by two phenyl groups.
• 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

• Solubilidade: Insoluble in water
• Sensibilidade: Air sensitive
• Índice de refração: 1.587
• Ponto de inflamação (°C): 198.2ºC
• Ponto de ebulição (°C): 351.2±42.0 °C
• Ponto de fusão (°C): 195-198 °C(lit.)
• Peso molecular: 334.260 g/mol
• XLogP3: 4.500
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 2
• Exact Mass: 334.09 Da
• Monoisotopic Mass: 334.09 Da
• Topological Polar Surface Area: 52.000 Ų
• Heavy Atom Count: 23
• Formal Charge: 0
• Complexity: 352.000
• 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

Referências

1. Junhua Li, Zhipeng Xu, Junbin Liao, Edison Huixiang Ang, Xuanhua Chen, Junjie Mu, Jiangnan Shen.  (2024)  Revolutionary MOF-enhanced anion exchange membrane for precise monovalent anion separation through structural optimization and doping.  DESALINATION,      [PMID:] [10.1016/j.desal.2024.117352]

2. Zicheng Fan, Insub Noh, Changlong Zhuang, Qingqing Liu, Yanbin Wang, Hyung Do Kim, Meng Yue, Hideo Ohkita, Biaobing Wang.  (2023)  A polar polyimide as multifunctional flame retardant for epoxy resin through constructing intimate 3D interpenetrating polymer network.  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2023.112383]

3. Haiyang Dai, Yang Zhang, Yang Yang, Jing Chen, Chongyang Li, Hao Liu, Wentao Liu, Xin Li, Tingting Zhang, Renzhong Xue, Tao Li.  (2024)  The influence of diamine structure on low dielectric constant and comprehensive properties of fluorinated polyimide films.  EUROPEAN POLYMER JOURNAL,      [PMID:] [10.1016/j.eurpolymj.2024.113614]

4. Xiao-Lin Wang, Qian-Hao Chen, Qi-Hui Ye, Hao Ye, Yu-Ting Zhao, Jing Yang, Yucong Yu, Ming-Bang Wu, Juming Yao.  (2026)  Fully aromatic fluorinated polyamide nanofiltration membranes formed at gas/liquid interfaces with ultrafast nonpolar organic solvent permeance.  JOURNAL OF MEMBRANE SCIENCE,      [PMID:] [10.1016/j.memsci.2026.125427]

5. Rouwen Shen, Yu Li, Sufen Jiang, Aimei Zhu, Qinglin Liu, Qiugen Zhang.  (2026)  High permeance of BAHFP-PA membrane prepared by cosolvent assisted interfacial polymerization.  SEPARATION AND PURIFICATION TECHNOLOGY,      [PMID:] [10.1016/j.seppur.2026.139251]