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1-Bromo-4-propylbenzene

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CAS:588-93-2
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1-Bromo-4-propylbenzene manufacturers

  • 1-Bromo-4-propylbenzene
  • 1-Bromo-4-propylbenzene pictures
  • $100.00 / 1KG
  • 2025-09-25
  • CAS:588-93-2
  • Min. Order: 1KG
  • Purity: 99%
  • Supply Ability: g-kg-tons, free sample is available
1-Bromo-4-propylbenzene Basic information
Product Name:1-Bromo-4-propylbenzene
Synonyms:P-BROMOPROPYLBENZENE;1-Brom-4-propylbenzol;4-Propyl-1-bromobenzene;benzene,1-bromo-4-propyl-;p-Bromo-n-propylbenzene;4-Bromo-N-Pentylbenzene,5PbrC11H13Br;1-BROMO-4-PROPYLBENZENE / 4-BROMOPROPYLBENZENE;1-BROMO-4-PROPYLBENZENE 99%
CAS:588-93-2
MF:C9H11Br
MW:199.09
EINECS:454-790-0
Product Categories:Building Blocks;C9 to C12;Chemical Synthesis;Halogenated Hydrocarbons;Organic Building Blocks;Aryl;C9 to C12;Halogenated Hydrocarbons;4-Alkylbromobenzenes (Building Blocks for Liquid Crystals);Building Blocks for Liquid Crystals;Functional Materials;Benzene derivates;bc0001
Mol File:588-93-2.mol
1-Bromo-4-propylbenzene Structure
1-Bromo-4-propylbenzene Chemical Properties
Melting point -41.4°C
Boiling point 225 °C(lit.)
density 1.286 g/mL at 25 °C(lit.)
vapor pressure 4.7Pa at 25℃
refractive index n20/D 1.537(lit.)
Fp 203 °F
storage temp. Inert atmosphere,Room Temperature
form Liquid
color Clear colorless to slightly yellow
Specific Gravity1.286
Water Solubility 2.867mg/L at 20℃
InChIInChI=1S/C9H11Br/c1-2-3-8-4-6-9(10)7-5-8/h4-7H,2-3H2,1H3
InChIKeyNUPWGLKBGVNSJX-UHFFFAOYSA-N
SMILESC1(Br)=CC=C(CCC)C=C1
LogP4.9 at 25℃
CAS DataBase Reference588-93-2(CAS DataBase Reference)
Safety Information
Hazard Codes Xi
Risk Statements 36/37/38
Safety Statements 26-37/39
WGK Germany 3
Hazard Note Irritant
HS Code 29036990
Storage Class10 - Combustible liquids
Hazard ClassificationsAquatic Acute 1
Aquatic Chronic 1
Eye Dam. 1
Skin Irrit. 2
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
1-Bromo-4-propylbenzene Usage And Synthesis
Description1-Bromo-4-propylbenzene is an aliphatic hydrocarbon compound containing a bromine functional group in its structure. This feature is crucial for its role in chemical reactions for synthesising other complex structures. 1-Bromo-4-propylbenzene can be used to prepare cyclopalladium catalysts.
Chemical PropertiesClear colorless to slightly yellow liquid
UsesIntermediates of Liquid Crystals
Flammability and ExplosibilityNot classified
Synthesis
1,4-Dibromobenzene

106-37-6

1-Bromopropane

106-94-5

1-Bromo-4-propylbenzene

588-93-2

General procedure: 236 g of 1,4-dibromobenzene, 185 g of bromopropane and 1 liter of anhydrous tetrahydrofuran were added to a 2-liter three-neck flask under nitrogen protection. Subsequently, 204 g of zinc chloride, 36 g of magnesium powder and 18 g of iron acetylacetonate were added as catalyst. The reaction mixture was heated to about 40°C under stirring conditions and the reaction started immediately. The reaction temperature was maintained at no more than 60°C for 8 hours. Upon completion of the reaction, the mixture was cooled to room temperature and the reaction was quenched by the addition of 200 ml of water. The tetrahydrofuran solvent was recovered by distillation and the residue was diluted with 500 mL of toluene. The toluene layer was separated, washed twice sequentially with 200 mL of saturated brine and dried over anhydrous sodium sulfate. The dried solution was filtered and the filtrate recovered toluene by distillation. Finally, the 94-97 °C/10 mmHg fraction was collected by vacuum distillation to give 170 g of 4-propylbromobenzene in 85% yield.

References[1] Patent: CN106278811, 2017, A. Location in patent: Paragraph 0035-0047
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