Uses
ChemicalBook > CAS DataBase List > 2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE

2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE

Uses
Product Name
2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE
CAS No.
66417-30-9
Chemical Name
2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE
Synonyms
3-BROMO-4-METHYLBENZOTRIFLUORIDE;2-Bromo-4-(trifluoromethyl)toluene;5-BROMO-2-METHYLBENZOTRIFLUORIDE, 97+%;2-Methyl-5-(trifluoroMethyl)broMobenzen;2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE;Benzene, 2-bromo-1-methyl-4-(trifluoromethyl)-
CBNumber
CB8249650
Molecular Formula
C8H6BrF3
Formula Weight
239.03
MOL File
66417-30-9.mol
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2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE Property

Boiling point:
183.0±35.0 °C(Predicted)
Density 
1.538±0.06 g/cm3(Predicted)
storage temp. 
2-8°C
form 
liquid
color 
Clear, colourless
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Safety

Hazard Codes 
F,Xn
Risk Statements 
22
Hazard Note 
Flammable
HazardClass 
IRRITANT
HS Code 
2903998090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

P261Avoid breathing dust/fume/gas/mist/vapours/spray.

P304+P340IF INHALED: Remove victim to fresh air and Keep at rest in a position comfortable for breathing.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

P405Store locked up.

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N-Bromosuccinimide Price

American Custom Chemicals Corporation
Product number
HCH0004389
Product name
3-BROMO-4-METHYL BENZOTRIFLUORIDE
Purity
95.00%
Packaging
1G
Price
$610.97
Updated
2021/12/16
American Custom Chemicals Corporation
Product number
HCH0004389
Product name
3-BROMO-4-METHYL BENZOTRIFLUORIDE
Purity
95.00%
Packaging
5G
Price
$845.34
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB32868
Product name
2-Bromo-1-methyl-4-(trifluoromethyl)benzene
Packaging
10g
Price
$200
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB32868
Product name
2-Bromo-1-methyl-4-(trifluoromethyl)benzene
Packaging
25g
Price
$400
Updated
2021/12/16
Biosynth Carbosynth
Product number
FB32868
Product name
2-Bromo-1-methyl-4-(trifluoromethyl)benzene
Packaging
5G
Price
$130
Updated
2021/12/16
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2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE Chemical Properties,Usage,Production

Uses

3-Bromo-4-methyltrifluorotoluene is an aromatic hydrocarbon derivative that can be used as an organic intermediate.

Synthesis

6140-17-6

66417-30-9

To 4-(trifluoromethyl)toluene (22b, 9.0 g, 56 mmol), 20 ml of trifluoroacetic acid (TFA) and 5.6 ml of 28% sulfuric acid (H2SO4) were added to a round bottom flask. N-bromosuccinimide (NBS, 10.0 g, 56 mmol, 1 equiv) was added to the reaction mixture in batches. The reaction was stirred overnight at room temperature.After 20 h, post-treatment was performed: the reaction mixture was poured into 100 ml of ice water and the organic layer (oily residue) was separated from the aqueous layer by extraction with ether (Et2O). The ether layers were combined, dried with anhydrous sodium sulfate (Na2SO4) and concentrated under reduced pressure to remove the solvent. The pure product 3-bromo-4-methylbenzotrifluoride (7.86 g, yield 59%) was obtained as a light yellow oil. Structural confirmation: The product was analyzed by RP-HPLC under the following conditions: HP 1100 HPLC system, Waters 3.9×150 mm NovaPak HR C18 guard column, injection volume of 0.010 mL, flow rate of 1.5 mL/min, injection loop of 1.500 mL, detection wavelength of 254 nm, mobile phase A was water (containing 0.1% v/v TFA). Mobile phase B was acetonitrile (containing 0.1% v/v TFA), gradient program: initial 10% B held for 1 min, linear increase to 80% B in 1-10 min, linear increase to 100% B in 10-11 min, held for 1 min. Product retention time was 11.7 min.1H NMR (400 MHz, CDCl3): δ 2.45 (s, 3H), 7.34 (d, J=8.0 Hz, 1H), 7.50 (d, J=8.0 Hz, 1H), 7.80 (s, 1H).

References

[1] Patent: WO2008/66921, 2008, A2. Location in patent: Page/Page column 69-70
[2] Journal of Organic Chemistry, 1978, vol. 43, p. 2941 - 2946

2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE Preparation Products And Raw materials

Raw materials

Preparation Products

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2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE Suppliers

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View Lastest Price from 2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE manufacturers

ZHENGZHOU JIUYI TIME NEW MATERIALS CO,.LTD
Product
2-Bromo-1-methyl-4-(trifluoromethyl)benzene 66417-30-9
Price
US $1.10-9.90/KG
Min. Order
1KG
Purity
99%min
Supply Ability
100KG
Release date
2025-08-20
Shaanxi Dideu Medichem Co. Ltd
Product
2-Methyl-5-(trifluoroMethyl)broMobenzen 66417-30-9
Price
US $0.00-0.00/KG
Min. Order
10mg
Purity
99%HPLC
Supply Ability
2000tons
Release date
2020-01-13
Hangzhou ICH Biofarm Co., Ltd
Product
2-METHYL-5-(TRIFLUOROMETHYL)BROMOBENZENE 66417-30-9
Price
US $0.00-0.00/g
Min. Order
1g
Purity
97%
Supply Ability
2000KG
Release date
2023-07-12