Cas no 395-44-8 (1-(Bromomethyl)-2-(trifluoromethyl)benzene)

1-(Bromomethyl)-2-(trifluoromethyl)benzene is a versatile aromatic compound featuring both a bromomethyl and a trifluoromethyl substituent on the benzene ring. This structure makes it a valuable intermediate in organic synthesis, particularly for introducing trifluoromethylated benzyl groups into target molecules. The bromomethyl group offers reactivity for nucleophilic substitution or cross-coupling reactions, while the electron-withdrawing trifluoromethyl group enhances stability and influences electronic properties. Its applications span pharmaceuticals, agrochemicals, and materials science, where fluorinated compounds are often sought for their unique physicochemical characteristics. The compound is typically handled under inert conditions due to the reactivity of the benzylic bromide moiety.
1-(Bromomethyl)-2-(trifluoromethyl)benzene structure
395-44-8 structure
Product Name:1-(Bromomethyl)-2-(trifluoromethyl)benzene
CAS No:395-44-8
MF:C8H6BrF3
MW:239.032452106476
MDL:MFCD00013558
CID:37217
PubChem ID:123057
Update Time:2025-10-31

1-(Bromomethyl)-2-(trifluoromethyl)benzene Chemical and Physical Properties

Names and Identifiers

    • 1-(Bromomethyl)-2-(trifluoromethyl)benzene
    • 2-(Trifluoromethyl)benzyl Bromide
    • o-(Trifluoromethyl)benzyl Bromide
    • 1-bromomethyl-2-trifluoromethylbenzene
    • 2-(Bromomethyl)benzotrifluoride
    • 2-Trifluoromethylbenzyl bromide
    • 2-trifluoromethylphenylmethyl bromide
    • alpha‘-Bromo-alpha,alpha,alpha-trifluoro-o-xylene
    • fxffr b1e
    • α-Bromo-α',α',α'-trifluoro-o-xylene
    • 2-(trifluoromethyl)benzylbromide
    • o-Trifluoromethylbenzyl bromide
    • Benzene, 1-(bromomethyl)-2-(trifluoromethyl)-
    • alpha'-Bromo-alpha,alpha,alpha-trifluoro-o-xylene
    • 1-Bromomethyl-2-trifluoromethyl-benzene
    • A'-BROMO-A,A,A-TRIFLUORO-O-XYLENE
    • 2-(bromomethyl)-1-(trifluoromethyl)benzene
    • 2-trifluoromethylbenzylbromide
    • 2-trifluor
    • A6616
    • NS00043191
    • F0001-1110
    • CS-W010300
    • EINECS 206-901-7
    • AM61525
    • 2-trifluoromethyl-benzylbromide
    • J-503505
    • ZH0005
    • DTXSID70192643
    • AC-16904
    • FT-0608964
    • 2-(trifluoromethyl)-benzyl bromide
    • AKOS009157777
    • T2768
    • 2-trifluoromethyl-benzyl bromide
    • MFCD00013558
    • EN300-198047
    • SCHEMBL4527
    • PS-9990
    • alpha-Bromo-alpha',alpha',alpha'-trifluoro-o-xylene
    • 2-trifluoromethyl benzyl bromide
    • 395-44-8
    • 2-(Trifluoromethyl)benzyl bromide, 96%
    • DB-013238
    • alpha-Bromo-alpha,alpha,alpha-trifluoro-o-xylene
    • MDL: MFCD00013558
    • Inchi: 1S/C8H6BrF3/c9-5-6-3-1-2-4-7(6)8(10,11)12/h1-4H,5H2
    • InChI Key: TXVVVEUSVBLDED-UHFFFAOYSA-N
    • SMILES: BrCC1C=CC=CC=1C(F)(F)F
    • BRN: 2256977

Computed Properties

  • Exact Mass: 237.96000
  • Monoisotopic Mass: 237.96
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 144
  • 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: 0
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3.4

Experimental Properties

  • Color/Form: Not available
  • Density: 1.571?g/mL?at 25?°C(lit.)
  • Melting Point: 34-35 oC
  • Boiling Point: 72°C/8mmHg(lit.)
  • Flash Point: Fahrenheit: 181.4 ° f < br / > Celsius: 83 ° C < br / >
  • Refractive Index: n20/D 1.494(lit.)
  • PSA: 0.00000
  • LogP: 3.60030
  • Solubility: Not available
  • Sensitiveness: Lachrymatory

1-(Bromomethyl)-2-(trifluoromethyl)benzene Security Information

  • Symbol: GHS05
  • Prompt:dangerous
  • Signal Word:Danger
  • Hazard Statement: H314
  • Warning Statement: P280,P305+P351+P338,P310
  • Hazardous Material transportation number:UN 3265
  • WGK Germany:3
  • Hazard Category Code: 34
  • Safety Instruction: S25-S36/37/39-S45
  • Hazardous Material Identification: C
  • Safety Term:S25;S36/37/39;S45
  • Packing Group:III
  • Packing Group:III
  • Risk Phrases:R34
  • Storage Condition:Keep away from high temperature, sparks, flames and fire sources. Store in tightly closed containers. Store in a cool, dry, well ventilated area away from incompatible substances.
  • HazardClass:8
  • PackingGroup:II

1-(Bromomethyl)-2-(trifluoromethyl)benzene 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%

1-(Bromomethyl)-2-(trifluoromethyl)benzene Pricemore >>

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1-(Bromomethyl)-2-(trifluoromethyl)benzene Suppliers

Tiancheng Chemical (Jiangsu) Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:395-44-8)2-(三氟甲基)芐溴
Order Number:LE1635315
Stock Status:in Stock
Quantity:25KG,200KG,1000KG
Purity:99%
Pricing Information Last Updated:Friday, 20 June 2025 12:30
Price ($):discuss personally
Suzhou Senfeida Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
(CAS:395-44-8)2-(Trifluoromethyl)benzyl bromide
Order Number:sfd18086;1635315
Stock Status:in Stock
Quantity:200kg/Company Customization
Purity:99.9%/98%
Pricing Information Last Updated:Friday, 19 July 2024 14:38
Price ($):discuss personally

Additional information on 1-(Bromomethyl)-2-(trifluoromethyl)benzene

Comprehensive Guide to 1-(Bromomethyl)-2-(trifluoromethyl)benzene (CAS No. 395-44-8): Properties, Applications, and Industry Insights

1-(Bromomethyl)-2-(trifluoromethyl)benzene (CAS No. 395-44-8) is a specialized organic intermediate widely utilized in pharmaceutical, agrochemical, and material science research. This compound, featuring a bromomethyl group and a trifluoromethyl substituent on a benzene ring, exhibits unique reactivity, making it valuable for cross-coupling reactions and fluorine-containing compound synthesis. Its molecular formula, C8H6BrF3, and precise structural characteristics contribute to its versatility in modern synthetic chemistry.

In recent years, the demand for fluorinated aromatic compounds like 1-(Bromomethyl)-2-(trifluoromethyl)benzene has surged due to their role in developing bioactive molecules and advanced materials. Researchers frequently search for "CAS 395-44-8 solubility," "bromomethyl benzene derivatives applications," or "trifluoromethyl group reactivity," reflecting growing interest in its physicochemical properties. The compound’s lipophilicity and electron-withdrawing effects are particularly relevant in drug design, where the CF3 group enhances metabolic stability.

Synthetic routes to 395-44-8 often involve radical bromination or electrophilic aromatic substitution of precursor molecules. Industry professionals emphasize optimizing "high-purity 1-(Bromomethyl)-2-(trifluoromethyl)benzene synthesis" to meet stringent quality standards for API manufacturing. Analytical techniques such as HPLC, NMR, and GC-MS are critical for verifying its purity, as impurities may affect downstream reactions in catalyzed processes.

Environmental and safety considerations for handling CAS 395-44-8 align with general laboratory protocols for organobromine compounds. While not classified as hazardous under standard regulations, proper storage in amber glass containers under inert atmospheres is recommended to prevent degradation. Users often inquire about "stability of bromomethyl-trifluoromethyl benzene" or "compatible solvents for 395-44-8," highlighting practical concerns in industrial applications.

Emerging trends link 1-(Bromomethyl)-2-(trifluoromethyl)benzene to innovations in OLED materials and liquid crystals, where its fluorine atoms improve thermal and electronic properties. Patent analyses reveal its use in photoresist polymers for semiconductor fabrication, addressing queries like "fluorinated benzene derivatives in electronics." Additionally, its role in constructing PET radiotracers showcases interdisciplinary relevance in medicinal chemistry.

For procurement, suppliers typically offer 395-44-8 in scales ranging from gram to kilogram quantities, with certifications like COA (Certificate of Analysis) ensuring batch consistency. SEO-optimized searches such as "buy 1-(Bromomethyl)-2-(trifluoromethyl)benzene online" or "CAS 395-44-8 suppliers" reflect commercial demand. Pricing varies based on purity (≥98% or ≥99%) and packaging specifications, with custom synthesis options available for specialized research needs.

Future prospects for this compound include expanded applications in click chemistry and metal-organic frameworks (MOFs), driven by the need for functionalized aromatic building blocks. As sustainable chemistry gains traction, methods for green bromination of trifluoromethyl-substituted arenes may further enhance its appeal. This positions 1-(Bromomethyl)-2-(trifluoromethyl)benzene as a keystone in next-generation chemical innovation.

Recommended suppliers
Tiancheng Chemical (Jiangsu) Co., Ltd
(CAS:395-44-8)2-(三氟甲基)芐溴
LE1635315
Purity:99%
Quantity:25KG,200KG,1000KG
Price ($):Inquiry
Email
Suzhou Senfeida Chemical Co., Ltd
(CAS:395-44-8)2-(Trifluoromethyl)benzyl bromide
sfd18086;1635315
Purity:99.9%/98%
Quantity:200kg/Company Customization
Price ($):Inquiry/Inquiry
Email