α,α'-Dichloro-p-xylene - ≥98%, used for α,α′-Dichloro-p-xylene is a monomer used in preparation of poly(p-phenylene vinylene(PPV) nanotubes and nanorods by chemical vapor deposition (CVD) polymerization method. α,α′-Dichloro-p-xylene was used in a study t

CAS: 623-25-6 Cat. No.: D104515 Formule: C₈H₈Cl₂ Poids moléculaire: 175.06 Beilstein Registry Number: 774706 Numéro CE: 210-782-7

GRADE & PURITY ≥98%

Synonyms

P-CHLOROMETHYLBENZYL CHLORIDE | p-Xylene, .alpha.,.alpha.'-dichloro- | p-Xylene,.alpha.'-dichloro- | 1,4-Bis(chloromethyl)benzene | 1,4-bis-(chloromethyl)benzene | D0430 | EN300-18944 | DTXSID7022091 | 1,4-Bis-(chlormethyl)-benzene | InChI=1/C8H8Cl2/c9-5-

Storage

Room temperature,Argon charged

Shipped In

Normal

Vue d’ensemble

α,α′-Dichloro-p-xylene undergoes phase transfer catalysed polycondensation with t-butylcyanoacetate to form carbon-carbon chain polymer

Specifications

Synonymes

P-CHLOROMETHYLBENZYL CHLORIDE | p-Xylene, .alpha.,.alpha.'-dichloro- | p-Xylene,.alpha.'-dichloro- | 1,4-Bis(chloromethyl)benzene | 1,4-bis-(chloromethyl)benzene | D0430 | EN300-18944 | DTXSID7022091 | 1,4-Bis-(chlormethyl)-benzene | InChI=1/C8H8Cl2/c9-5-

Spécifications et pureté

≥98%

Application

α,α′-Dichloro-p-xylene is a monomer used in preparation of poly(p-phenylene vinylene(PPV) nanotubes and nanorods by chemical vapor deposition (CVD) polymerization method. α,α′-Dichloro-p-xylene was used in a study to investigate the effect of CVD monomer

Conditions de stockage de stockage

Room temperature,Argon charged

Expédié en

Normal

Pureté

≥98%

Noms et identifiants

Pubchem Sid

504752275

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752275

Sourires canoniques

C1=CC(=CC=C1CCl)CCl

IUPAC Name

1,4-bis(chloromethyl)benzene

InChIKey

ZZHIDJWUJRKHGX-UHFFFAOYSA-N

INCHI

1S/C8H8Cl2/c9-5-7-1-2-8(6-10)4-3-7/h1-4H,5-6H2

Isomères SMILES

C1=CC(=CC=C1CCl)CCl

WGK Allemagne

3

RTECS

ZE4100000

Numéro ONU

3335

Poids moléculaire

175.06

Beilstein

774706

Reaxy-Rn

774706

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=774706&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Benzyl halides
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzyl chlorides
• Alternative Parents: Organochlorides Hydrocarbon derivatives Alkyl chlorides
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Benzyl chloride - Hydrocarbon derivative - Organochloride - Organohalogen compound - Alkyl halide - Alkyl chloride - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as benzyl chlorides. These are organic compounds containing a benzene skeleton substituted with a chloromethyl 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

Propriétés chimiques et physiques

• Solubilité: Decomposition in water, soluble in acetone and dichloromethane, methanol solubility: 50 mg/ml
• Sensibilité: heat and Moisture sensitive
• Point d'ébullition (°C): 254°C
• Point de fusion (°C): 98-102°C
• Poids moléculaire: 175.050 g/mol
• XLogP3: 2.700
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 2
• Exact Mass: 174 Da
• Monoisotopic Mass: 174 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 73.300
• 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