ChemicalBook > CAS DataBase List > 3-Bromo-6-fluoro-2-methyl-benzoic acid

3-Bromo-6-fluoro-2-methyl-benzoic acid

Product Name
3-Bromo-6-fluoro-2-methyl-benzoic acid
CAS No.
1427373-55-4
Chemical Name
3-Bromo-6-fluoro-2-methyl-benzoic acid
Synonyms
3-Bromo-6-fluoro-2-methyl-benzoic acid;Benzoic acid, 3-bromo-6-fluoro-2-methyl-
CBNumber
CB43067510
Molecular Formula
C8H6BrFO2
Formula Weight
233.03
MOL File
1427373-55-4.mol
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3-Bromo-6-fluoro-2-methyl-benzoic acid Property

Boiling point:
307.2±42.0 °C(Predicted)
Density 
1.680±0.06 g/cm3(Predicted)
storage temp. 
Store at room temperature
form 
crystalline solid
pka
2.57±0.31(Predicted)
color 
White
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Safety

HS Code 
2916399090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H315Causes skin irritation

H319Causes serious eye irritation

H335May cause respiratory irritation

Precautionary statements

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

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

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N-Bromosuccinimide Price

TRC
Product number
B683125
Product name
3-Bromo-6-fluoro-2-methylbenzoicAcid
Packaging
5g
Price
$2205
Updated
2021/12/16
ChemScene
Product number
CS-0047306
Product name
3-Bromo-6-fluoro-2-methylbenzoicacid
Packaging
5g
Price
$2191
Updated
2021/12/16
AK Scientific
Product number
0239EA
Product name
3-Bromo-6-fluoro-2-methylbenzoicacid
Packaging
250mg
Price
$399
Updated
2021/12/16
ChemScene
Product number
CS-0047306
Product name
3-Bromo-6-fluoro-2-methylbenzoicacid
Packaging
1g
Price
$730
Updated
2021/12/16
Alichem
Product number
1427373554
Product name
3-Bromo-6-fluoro-2-methylbenzoicacid
Packaging
500mg
Price
$839.45
Updated
2021/12/16
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3-Bromo-6-fluoro-2-methyl-benzoic acid Chemical Properties,Usage,Production

Uses

3-Bromo-6-fluoro-2-methylbenzoic Acid acts as a reagent for the preparation of aryl and heteroaryl fused lactams as antitumor agents.

Synthesis

90259-27-1

1427373-55-4

General procedure for the synthesis of 3-bromo-6-fluoro-2-methylbenzoic acid from 2-fluoro-6-methylbenzoic acid: 2-fluoro-6-methylbenzoic acid (1.48 g, 9.60 mmol) was dissolved in a mixture of concentrated hydrochloric and sulfuric acids (40 mL) at 0 °C. Subsequently, N-bromosuccinimide (NBS, 1.79 g, 10.1 mmol) was added to this solution. The reaction mixture was stirred continuously at 0 °C for 3 hours. After completion of the reaction, the mixture was poured into ice water (200 mL) and extracted with ether (2 x 200 mL). The organic phases were combined, dried with anhydrous sodium sulfate and subsequently concentrated under reduced pressure to afford the target product 3-bromo-6-fluoro-2-methylbenzoic acid (Compound QQ, 2.15 g, 96% yield) as a solid. The structure of the product was confirmed by 1H NMR (400 MHz, chloroform-d): δ 7.64 (dd, J = 8.84,5.31 Hz, 1H), 6.92 (t, J = 8.84 Hz, 1H), 2.54 (s, 3H); mass spectrometry (MS) showed the molecular ion peak [M + H]+ as 231.0.

References

[1] Patent: US2014/179667, 2014, A1. Location in patent: Paragraph 0816; 0817
[2] Patent: WO2013/37705, 2013, A2. Location in patent: Page/Page column 143
[3] Patent: WO2014/33170, 2014, A1. Location in patent: Page/Page column 99; 100
[4] Patent: WO2014/33176, 2014, A1. Location in patent: Page/Page column 99-100

3-Bromo-6-fluoro-2-methyl-benzoic acid Preparation Products And Raw materials

Raw materials

Preparation Products

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3-Bromo-6-fluoro-2-methyl-benzoic acid Suppliers

Xinyanhe Pharmatech Co.,Ltd
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1427373-55-4, 3-Bromo-6-fluoro-2-methyl-benzoic acidRelated Search:


  • 3-Bromo-6-fluoro-2-methyl-benzoic acid
  • Benzoic acid, 3-bromo-6-fluoro-2-methyl-
  • 1427373-55-4