Cas no 25006-86-4 (Benzene,1,3-bis(bromomethyl)-2-fluoro-)

Benzene,1,3-bis(bromomethyl)-2-fluoro- is a fluorinated and brominated aromatic compound characterized by its reactive bromomethyl and fluoro substituents. The presence of two bromomethyl groups enhances its utility as an intermediate in organic synthesis, particularly in cross-coupling reactions and polymer modifications. The fluorine substituent further influences its electronic properties, making it valuable in the development of specialty chemicals and advanced materials. Its reactivity allows for selective functionalization, enabling applications in pharmaceuticals, agrochemicals, and material science. The compound's stability under controlled conditions ensures reliable handling in laboratory and industrial settings. Its structural features make it a versatile building block for synthesizing complex molecular architectures.
Benzene,1,3-bis(bromomethyl)-2-fluoro- structure
25006-86-4 structure
Product Name:Benzene,1,3-bis(bromomethyl)-2-fluoro-
CAS No:25006-86-4
MF:C8H7Br2F
MW:281.94758439064
CID:241195
PubChem ID:2736003
Update Time:2025-10-31

Benzene,1,3-bis(bromomethyl)-2-fluoro- Chemical and Physical Properties

Names and Identifiers

    • Benzene,1,3-bis(bromomethyl)-2-fluoro-
    • 1,3-Bis(bromomethyl)-2-fluorobenzene
    • 1,3-Bisbromomethyl-2-fluorobenzene
    • 25006-86-4
    • A817599
    • 2,6-bis(bromomethyl)fluorobenzene
    • 1,3-bis(bromomethyl)-2-fluoranyl-benzene
    • LFPRPXHVBUBKOS-UHFFFAOYSA-N
    • MFCD00042469
    • 2-fluoro-m-xylylene dibromide
    • DTXSID70371077
    • 1, 3-bis(bromomethyl)-2-fluorobenzene
    • 2,6-bis(bromomethyl)-1-fluorobenzene
    • FT-0606567
    • Benzene, 1,3-bis(bromomethyl)-2-fluoro-
    • SCHEMBL960397
    • DB-086566
    • G88811
    • MDL: MFCD00042469
    • Inchi: 1S/C8H7Br2F/c9-4-6-2-1-3-7(5-10)8(6)11/h1-3H,4-5H2
    • InChI Key: LFPRPXHVBUBKOS-UHFFFAOYSA-N
    • SMILES: BrCC1C=CC=C(CBr)C=1F

Computed Properties

  • Exact Mass: 279.89000
  • Monoisotopic Mass: 279.89
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 0
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 2
  • Complexity: 107
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 0A^2
  • XLogP3: 3.1

Experimental Properties

  • Density: 1.847
  • Melting Point: 88-90°C
  • Boiling Point: 275.3°Cat760mmHg
  • Flash Point: 120.3°C
  • Refractive Index: 1.59
  • PSA: 0.00000
  • LogP: 3.61550

Benzene,1,3-bis(bromomethyl)-2-fluoro- Security Information

Benzene,1,3-bis(bromomethyl)-2-fluoro- Customs Data

  • HS CODE:2903999090
  • Customs Data:

    China Customs Code:

    2903999090

    Overview:

    2903999090 Other aromatic halogenated derivatives. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:5.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2903999090 halogenated derivatives of aromatic hydrocarbons VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% General tariff:30.0%

Benzene,1,3-bis(bromomethyl)-2-fluoro- Pricemore >>

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Benzene,1,3-bis(bromomethyl)-2-fluoro- Related Literature

  • 1. The synthesis of novel bisphosphonates as inhibitors of phosphoglycerate kinase (3-PGK)
    Neil A. Caplan,Christopher I. Pogson,David J. Hayes,G. Michael Blackburn J. Chem. Soc. Perkin Trans. 1 2000 421

Additional information on Benzene,1,3-bis(bromomethyl)-2-fluoro-

Comprehensive Analysis of Benzene,1,3-bis(bromomethyl)-2-fluoro- (CAS No. 25006-86-4)

Benzene,1,3-bis(bromomethyl)-2-fluoro- (CAS No. 25006-86-4) is a halogenated aromatic compound with significant applications in organic synthesis and material science. Its molecular structure, featuring two bromomethyl groups and a fluoro substituent, makes it a versatile intermediate for constructing complex molecules. Researchers and industries frequently search for "1,3-bis(bromomethyl)-2-fluorobenzene synthesis" or "CAS 25006-86-4 properties," highlighting its relevance in advanced chemical workflows.

The compound's unique reactivity stems from the electron-withdrawing effects of the fluoro group and the nucleophilic potential of the bromomethyl moieties. This dual functionality enables its use in cross-coupling reactions, polymer modifications, and pharmaceutical derivatization. Recent trends in "green chemistry alternatives for halogenated intermediates" have spurred interest in optimizing its synthesis to reduce environmental impact while maintaining efficiency.

Analytical techniques such as NMR spectroscopy and mass spectrometry are essential for characterizing Benzene,1,3-bis(bromomethyl)-2-fluoro-. Users often inquire about "CAS 25006-86-4 spectral data" or "safe handling protocols for bromomethyl compounds," reflecting the need for precise technical guidance. Its stability under controlled conditions and compatibility with common solvents like THF or DMF further enhance its utility in lab-scale and industrial processes.

Emerging applications include its role in designing high-performance polymers and photoactive materials, aligning with the growing demand for "specialty chemicals for electronics." Innovations in catalytic systems have also leveraged its structure to achieve selective functionalization, addressing queries like "25006-86-4 catalytic applications." Regulatory compliance and sustainable sourcing remain critical discussion points, as evidenced by searches for "REACH compliance for fluorinated aromatics."

In summary, Benzene,1,3-bis(bromomethyl)-2-fluoro- exemplifies the intersection of synthetic utility and modern chemical challenges. Its adaptability to diverse reaction conditions and alignment with industry trends ensures continued relevance in research and development landscapes.

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