Chlorodiphenylmethane - ≥97% , CAS No.90-99-3

CAS: 90-99-3 Cat. No.: C103216 Fórmula: C₁₃H₁₁Cl Peso molecular: 202.68 Beilstein Registry Number: 607925 Número CE: 202-031-7

GRADE & PURITY ≥97%

Synonyms

Q-200687 | [Chloro(phenyl)methyl]benzene | CHLORODIPHENYLMETHANE | chloro-diphenyl-methane | N-(4-FLUOROPHENYL)ANTHRANILICACID | EN300-20926 | Q27275553 | (Chloromethylene)dibenzene | Benzene,1'-(chloromethylene)bis- | EINECS 202-031-7 | 1,1-Diphenylchlor

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Visão geral

Chlorodiphenylmethane was used as initiator during the controlled radical polymerization of styrene catalyzed by ionic iron complex. It was also used as the starting reagent in the synthesis of trimethylhydroquinone derivatives。

Specifications

Sinónimos

Q-200687 | [Chloro(phenyl)methyl]benzene | CHLORODIPHENYLMETHANE | chloro-diphenyl-methane | N-(4-FLUOROPHENYL)ANTHRANILICACID | EN300-20926 | Q27275553 | (Chloromethylene)dibenzene | Benzene,1'-(chloromethylene)bis- | EINECS 202-031-7 | 1,1-Diphenylchlor

Especificações e pureza

≥97%

Condições de armazenamento de armazenamento

Store at 2-8°C,Argon charged

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥97%

Nomes e identificadores

• Pubchem Sid: 508812302
• Sorrisos canónicos: C1=CC=C(C=C1)C(C2=CC=CC=C2)Cl
• IUPAC Name: [chloro(phenyl)methyl]benzene
• InChIKey: ZDVDCDLBOLSVGM-UHFFFAOYSA-N
• INCHI: 1S/C13H11Cl/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10,13H
• SMILES isoméricas: C1=CC=C(C=C1)C(C2=CC=CC=C2)Cl
• WGK Alemanha: 3
• Número UN: 3265
• Grupo de embalagem: II
• Peso molecular: 202.68
• Beilstein: 607925
• Reaxy-Rn: 607925
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=607925&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: Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Diphenylmethane - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - 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

Propriedades químicas e físicas

• Solubilidade: Insoluble in water.
• Sensibilidade: Moisture sensitive
• Índice de refração: 1.595
• Ponto de inflamação (°F): 233.6 °F
• Ponto de inflamação (°C): 160°C
• Ponto de ebulição (°C): 116°C/1mmHg
• Ponto de fusão (°C): 15-17°C
• Peso molecular: 202.680 g/mol
• XLogP3: 3.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 202.055 Da
• Monoisotopic Mass: 202.055 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 137.000
• 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. Yang Wang, Wei Zhao, Xinli Liu, Dongmei Cui, Eugene Y.-X. Chen.  (2012)  Ligand-Free Magnesium Catalyst System: Immortal Polymerization of l-Lactide with High Catalyst Efficiency and Structure of Active Intermediates.  MACROMOLECULES,      [PMID:] [10.1021/ma3007625]

2. Saqlain Raza, Amin Abid, Isham Areej, Shahid Nazeer, Ahmad Kaleem Qureshi, Bien Tan.  (2024)  Fabrication of Phosphorus- and Nitrogen-Rich Inorganic–Organic Hybrid Hyper-Cross-Linked Polymers for CO2 and I2 Uptake.  ACS Applied Polymer Materials,      [PMID:] [10.1021/acsapm.4c01110]