ChemicalBook > CAS DataBase List > 3-Fluoro-5-bromoaniline

3-Fluoro-5-bromoaniline

Product Name
3-Fluoro-5-bromoaniline
CAS No.
134168-97-1
Chemical Name
3-Fluoro-5-bromoaniline
Synonyms
3-BroMo-5-fluoro-phenylaMine;5-BroMo-3-fluoroaniline;3-Fluoro-5-bromoaniline;3-Bromo-5-fluoroaniline 97%;3-Bromo-5-fluorobenzenamine;3-Bromo-5-fluoroaniline,95%;Benzenamine, 3-bromo-5-fluoro-
CBNumber
CB12500057
Molecular Formula
C6H5BrFN
Formula Weight
190.01
MOL File
134168-97-1.mol
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3-Fluoro-5-bromoaniline Property

Boiling point:
246℃
Density 
1.694
Flash point:
102℃
storage temp. 
under inert gas (nitrogen or Argon) at 2–8 °C
pka
2.51±0.10(Predicted)
form 
Liquid
color 
Brown
InChI
InChI=1S/C6H5BrFN/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2
InChIKey
NGZAVSDIXFIWHJ-UHFFFAOYSA-N
SMILES
C1(N)=CC(F)=CC(Br)=C1
CAS DataBase Reference
134168-97-1
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Safety

RIDADR 
UN2811
HazardClass 
6.1
HS Code 
2921420090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Warning
Hazard statements

H302Harmful if swallowed

H312Harmful in contact with skin

H315Causes skin irritation

H319Causes serious eye irritation

H332Harmful if inhaled

H335May cause respiratory irritation

Precautionary statements

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

P280Wear protective gloves/protective clothing/eye protection/face protection.

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

TRC
Product number
B679178
Product name
3-Bromo-5-fluoroaniline
Packaging
100mg
Price
$75
Updated
2021/12/16
Matrix Scientific
Product number
074376
Product name
3-Bromo-5-fluoroaniline
Purity
95+%
Packaging
1g
Price
$80
Updated
2021/12/16
Apolloscientific
Product number
PC49300
Product name
3-Bromo-5-fluoroaniline
Purity
97%
Packaging
5g
Price
$119
Updated
2021/12/16
Apolloscientific
Product number
PC49300
Product name
3-Bromo-5-fluoroaniline
Purity
97%
Packaging
1g
Price
$41
Updated
2021/12/16
SynQuest Laboratories
Product number
3630-B-X4
Product name
3-Bromo-5-fluoroaniline
Packaging
1g
Price
$45
Updated
2021/12/16
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3-Fluoro-5-bromoaniline Chemical Properties,Usage,Production

Synthesis

807620-95-7

134168-97-1

N-(3-bromo-5-fluorophenyl)acetamide (Intermediate 181, 8.7 g, 37.4 mmol) was used as a raw material, which was dissolved in ethanol (30 mL) and then concentrated hydrochloric acid (80 mL) was slowly added. The reaction mixture was heated to 100 °C and kept for 1 h for the reaction. After completion of the reaction, the mixture was cooled to room temperature and neutralized with 5 N sodium hydroxide solution. The crude product was extracted with ethyl acetate (2 x 100 mL) and the combined organic layers were washed with brine and dried over anhydrous magnesium sulfate. After filtration, the solvent was removed by concentration under reduced pressure. Purification by silica gel column chromatography using a gradient elution with 5-10% ethyl acetate in hexane solution gave 5.3 g (75% yield) of the yellow oily target product 3-bromo-5-fluoroaniline (Intermediate 180). Mass spectrum (ES+): m/z 190, 192 ([M+H]+), molecular formula C6H5BrFN. 1H NMR (DMSO-d6) δ: 5.46-6.00 (m, 2H), 6.24-6.37 (m, 1H), 6.44-6.53 (m, 1H), 6.54-6.61 (m, 1H).

References

[1] Bioorganic and Medicinal Chemistry Letters, 2004, vol. 14, # 22, p. 5477 - 5480
[2] Bioorganic and Medicinal Chemistry Letters, 2005, vol. 15, # 22, p. 5061 - 5064
[3] Patent: WO2006/134378, 2006, A1. Location in patent: Page/Page column 149

3-Fluoro-5-bromoaniline Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 3-Fluoro-5-bromoaniline manufacturers

Career Henan Chemical Co
Product
3-Fluoro-5-bromoaniline 134168-97-1
Price
US $1.00/g
Min. Order
1g
Purity
99%
Supply Ability
10000KGS
Release date
2020-01-09

134168-97-1, 3-Fluoro-5-bromoanilineRelated Search:


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  • 3-Bromo-5-fluoroaniline 97%
  • 3-BroMo-5-fluoro-phenylaMine
  • Benzenamine, 3-bromo-5-fluoro-
  • 3-Bromo-5-fluoroaniline,95%
  • 3-Bromo-5-fluorobenzenamine
  • 134168-97-1