30752-19-3

Basic information

• Product Name: 4-N-HEXYLOXYBROMOBENZENE
• Synonyms: 1-(4-BROMOPHENOXY)HEXANE;1-BROMO-4-HEXYLOXYBENZENE;1-BROMO-4-N-HEXYLOXYBENZENE;4-BROMOPHENYL HEXYL ETHER;4-N-HEXYLOXYBROMOBENZENE;P-HEXYLOXYBROMOBENZENE;P-BROMO(HEXYLOXY)BENZENE;TIMTEC-BB SBB008641
• CAS NO: 30752-19-3
• Molecular Formula: C₁₂H₁₇BrO
• Molecular Weight: 257.17
• Mol File: 30752-19-3.mol
• Article Data: 38

Chemical Properties

• Boiling Point: 154°C/12mmHg(lit.)
• Flash Point: >110°(230°F)
• Appearance: /
• Density: 1,23 g/cm3
• Vapor Pressure: 0.00226mmHg at 25°C
• Refractive Index: 1.5240
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 4-N-HEXYLOXYBROMOBENZENE(CAS DataBase Reference)
• NIST Chemistry Reference: 4-N-HEXYLOXYBROMOBENZENE(30752-19-3)
• EPA Substance Registry System: 4-N-HEXYLOXYBROMOBENZENE(30752-19-3)

Safety Data

• TSCA: Yes
• Hazardous Substances Data: 30752-19-3(Hazardous Substances Data)

Usage

General Description

4-N-HEXYLOXYBROMOBENZENE is a chemical compound with the chemical formula C12H17BrO. It is a brominated benzene derivative with a hexyloxy substituent at the 4-position. 4-N-HEXYLOXYBROMOBENZENE is commonly used in organic synthesis and research as a building block for the preparation of various other organic compounds. It is also used in the production of pharmaceuticals, agrochemicals, and as a reagent in chemical reactions. 4-N-HEXYLOXYBROMOBENZENE is a highly flammable and hazardous substance that should be handled with caution and in accordance with safety procedures.

InChI:InChI=1/C12H17BrO/c1-2-3-4-5-10-14-12-8-6-11(13)7-9-12/h6-9H,2-5,10H2,1H3

Upstream product

• 1132-66-7 1-phenoxyhexane 
• 111-25-1 1-bromo-hexane 
• 589-87-7 1,4-bromoiodobenzene 
• 1403266-85-2 1-bromo-4-((6-iodohexyl)oxy)benzene 
• 106-37-6 1.4-dibromobenzene 
• 111-27-3 hexan-1-ol 
• 106-41-2 4-bromo-phenol 
• 133080-87-2 4-Bromo-1-(6-hydroxyhexan-1-yloxy)benzene 
• 638-45-9 1-Iodohexane 

Downstream Products

• 50353-64-5 1-(4-n-hexyloxyphenyl)-2-(4'-hydroxyphenyl)acetylene 
• 125177-27-7 4-(p-hexyloxyphenyl)-2-methyl-3-butyn-2-ol 
• 5736-94-7 4-(hexyloxy)benzaldehyde 
• 176967-76-3 (4-(hexyloxy)phenyl)magnesium bromide 
• 1135-49-5 4-(n-hexyloxy)thiophenol 
• 952657-51-1 9-ethyl-3-(4-(n-hexyloxy)phenyl)-9H-carbazole 
• 1403613-81-9 3-bromo-10-[4-(hexyloxy)phenyl]-10H-phenothiazine 

Relevant articles and documents

Semiheterogeneous Dual Nickel/Photocatalytic (Thio)etherification Using Carbon Nitrides

A carbon nitride material can be combined with homogeneous nickel catalysts for light-mediated cross-couplings of aryl bromides with alcohols under mild conditions. The metal-free heterogeneous semiconductor is fully recyclable and couples a broad range of electron-poor aryl bromides with primary and secondary alcohols as well as water. The application for intramolecular reactions and the synthesis of active pharmaceutical ingredients was demonstrated. The catalytic protocol is applicable for the coupling of aryl iodides with thiols as well.

Derivative based on 1,3,5-triazine and fluorene unit and application thereof

The invention relates to a derivative based on a 1,3,5-triazine structure and a fluorene unit and application thereof. The 1,3,5-triazine derivative and the fluorenyl derivative are fixed into a single molecule through sp3 hybrid carbon atoms by means of a Pd(dba)2 catalytic C-H coupled reaction, and a bipolar body material is prepared. The synthesis method is simple, raw materials are easy to obtain, and industrial development is facilitated. The bipolar body material has the balanced carrier transport capability, the high triplet energy level, the wide energy gap and the high quantum efficiency. According to the bipolar body material, under the film state, due to the interplanar pi-pi effect of the 1,3,5-triazine, excimer fluorescence spectrum red shifting is formed. The body material has the good solubility in a common organic solvent and can be applied to preparing a solution machined electroluminescent device. The body material is applied to the electroluminescent device, the device efficiency is improved, driving voltage and efficiency roll-off are lowered, and the service life of the device is prolonged.

Probing the Hydrophobic Binding Pocket of G-Protein-Coupled Lysophosphatidylserine Receptor GPR34/LPS1 by Docking-Aided Structure-Activity Analysis

The ligands of certain G-protein-coupled receptors (GPCRs) have been identified as endogenous lipids, such as lysophosphatidylserine (LysoPS). Here, we analyzed the molecular basis of the structure-activity relationship of ligands of GPR34, one of the LysoPS receptor subtypes, focusing on recognition of the long-chain fatty acid moiety by the hydrophobic pocket. By introducing benzene ring(s) into the fatty acid moiety of 2-deoxy-LysoPS, we explored the binding site's preference for the hydrophobic shape. A tribenzene-containing fatty acid surrogate with modifications of the terminal aromatic moiety showed potent agonistic activity toward GPR34. Computational docking of these derivatives with a homology modeling/molecular dynamics-based virtual binding site of GPR34 indicated that a kink in the benzene-based lipid surrogates matches the L-shaped hydrophobic pocket of GPR34. A tetrabenzene-based lipid analogue bearing a bulky tert-butyl group at the 4-position of the terminal benzene ring exhibited potent GPR34 agonistic activity, validating the present hydrophobic binding pocket model.