m-Dibromobenzene - ≥97% , CAS No.108-36-1

CAS: 108-36-1 Cat. No.: D110983 Formule: C₆H₄Br₂ Poids moléculaire: 235.9 Beilstein Registry Number: 1904538 Numéro CE: 203-574-2

GRADE & PURITY ≥97%

Synonyms

D70875 | A801864 | UNII-74EF6KH8TC | Benzene, 1,3-dibromo- | 1, 3-dibromobenzene | AM84332 | W-108722 | BP-21249 | 1-BROMO-3-BROMOBENZENE | 1,3-Dibromobenzene, 97% | EINECS 203-574-2 | DTXSID7051555 | FT-0606628 | m-Dibromobenzene | SCHEMBL5000 | STR07103

Storage

Room temperature

Shipped In

Normal

Vue d’ensemble

1,3-Dibromobenzene undergoes solid-supported [KF-Al2O3] palladium-catalyzed polyarylation reaction with phenyl boronic acid under microwave irradiation to yield conjugated polyaryls

1,3-Dibromobenzene was used in the synthesis of [n]metacyclophanes via Suzuki coupling reaction

Specifications

Synonymes

D70875 | A801864 | UNII-74EF6KH8TC | Benzene, 1,3-dibromo- | 1, 3-dibromobenzene | AM84332 | W-108722 | BP-21249 | 1-BROMO-3-BROMOBENZENE | 1,3-Dibromobenzene, 97% | EINECS 203-574-2 | DTXSID7051555 | FT-0606628 | m-Dibromobenzene | SCHEMBL5000 | STR07103

Spécifications et pureté

≥97%

Conditions de stockage de stockage

Room temperature

Expédié en

Normal

Pureté

≥97%

Noms et identifiants

• Pubchem Sid: 488180608
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180608
• Sourires canoniques: C1=CC(=CC(=C1)Br)Br
• IUPAC Name: 1,3-dibromobenzene
• InChIKey: JSRLURSZEMLAFO-UHFFFAOYSA-N
• INCHI: 1S/C6H4Br2/c7-5-2-1-3-6(8)4-5/h1-4H
• Isomères SMILES: C1=CC(=CC(=C1)Br)Br
• WGK Allemagne: 2
• RTECS: CZ1790000
• Numéro ONU: 2711
• Poids moléculaire: 235.9
• Beilstein: 1904538
• Reaxy-Rn: 1904538
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1904538&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Classe: Benzene and substituted derivatives
• Subclass: Halobenzenes
• Intermediate Tree Nodes: Not available
• Direct Parent: Bromobenzenes
• Alternative Parents: Aryl bromides Organobromides Hydrocarbon derivatives
• Molecular Framework: Aromatic homomonocyclic compounds
• Substituents: Bromobenzene - Aryl halide - Aryl bromide - Hydrocarbon derivative - Organobromide - Organohalogen compound - Aromatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as bromobenzenes. These are organic compounds containing a bromine atom attached to a benzene ring.
• External Descriptors: dibromobenzene

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: Immiscible with water
• Indice de réfraction: 1.6083
• Point d'éclair (°F): 199.4 °F
• Point d'éclair (°C): 93℃
• Point d'ébullition (°C): 219.5°C
• Point de fusion (°C): -7°C
• Poids moléculaire: 235.900 g/mol
• XLogP3: 3.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 235.866 Da
• Monoisotopic Mass: 233.868 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 64.900
• 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

Références

1. Ziqi Sun, Meiling Qi.  (2022)  High separation performance of carbon dioxide-based poly(ether-carbonate) copolymer for gas chromatographic analyses.  JOURNAL OF CHROMATOGRAPHY A,      [PMID:36166885] [10.1016/j.chroma.2022.463493]

2. Pengzhong Shi, Jiawei Wang, Zhiyong Guo.  (2022)  A one-dimensional covalent organic framework film for near-infrared electrochromism.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2022.139082]

3. Qihang Yu, Wu Tang, Yang Hu, Jian Gao, Ming Wang, Sihong Liu, Huanhuan Lai, Liang Xu, Cong Fan.  (2021)  Novel low-cost, high-energy-density (>700 Wh kg−1) Li-rich organic cathodes for Li-ion batteries.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2021.128509]

4. Xue Xiong, Meiling Qi.  (2020)  A novel column fabrication approach for capillary gas chromatography via a cross-linked organogel network with high stability and inertness.  NEW JOURNAL OF CHEMISTRY,  44  (25): (10621-10627).  [PMID:] [10.1039/D0NJ02185G]

5. Kunlin Liu, Jiuzhou Wang, Ting Yang, Hong Wang, Chengyang Wang, Mingming Chen.  (2020)  An “in situ templating” strategy towards mesoporous carbon for high-rate supercapacitor and high-adsorption capacity on dye macromolecules.  CARBON,      [PMID:] [10.1016/j.carbon.2020.03.050]

Foire aux questions

What is the purity of this product?

This product is supplied at ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 108-36-1, the molecular formula is C6H4Br2, and the molecular weight is 235.9 g/mol. InChIKey JSRLURSZEMLAFO-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.