1716-42-3

Basic information

• Product Name: 1-(3-Chloropropoxy)-4-fluorobenzene
• Synonyms: 1-(3-chloropropoxy)-4-fluorobenzene,mixtureofchloro-andbromo-derivative;4-Fluorochloropropylanisole;TIMTEC-BB SBB003674;3-(4-FLUOROPHENOXY)PROPYL CHLORIDE;1-(3-CHLOROPROPOXY)-4-FLUOROBENZENE;1-CHLORO-3-(4-FLUOROPHENOXY)PROPANE;1-(4-fluorophenoxy)-3-chloropropane;3-CHLOROPROPYL 4-FLUOROPHENYL ETHER
• CAS NO: 1716-42-3
• Molecular Formula: C₉H₁₀ClFO
• Molecular Weight: 188.63
• EINECS: 217-000-3
• Mol File: 1716-42-3.mol
• Article Data: 7

Chemical Properties

• Boiling Point: 118-120 °C (10 mmHg)
• Flash Point: 114.5 °C
• Appearance: clear yellowish to orange liquid
• Density: 1.2
• Vapor Pressure: 0.0148mmHg at 25°C
• Refractive Index: 1.504-1.508
• Storage Temp.: Sealed in dry,Room Temperature
• CAS DataBase Reference: 1-(3-Chloropropoxy)-4-fluorobenzene(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(3-Chloropropoxy)-4-fluorobenzene(1716-42-3)
• EPA Substance Registry System: 1-(3-Chloropropoxy)-4-fluorobenzene(1716-42-3)

Safety Data

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 24/25-36-26
• RIDADR: 3265
• Hazardous Substances Data: 1716-42-3(Hazardous Substances Data)

Usage

Description

1-(3-Chloropropoxy)-4-fluorobenzene is a clear, yellowish to orange liquid with chemical properties that make it a versatile compound in various industries. It is characterized by its chloro and fluoro substituents, which contribute to its reactivity and potential applications.

Uses

1. Used in Pharmaceutical Industry:
1-(3-Chloropropoxy)-4-fluorobenzene is used as a reagent for the preparation of a library of hydantoin compounds. These compounds are utilized to study Aurora kinase A inhibitory activity, which is crucial in the development of potential therapeutic agents for various diseases.
2. Used in Neuropharmacology:
1-(3-Chloropropoxy)-4-fluorobenzene is used as an alkylation agent in the synthesis of tetracyclic quinoxaline butyrophenones. These compounds serve as 5-HT2A and postsynaptic D2 antagonists and inhibitors of the serotonin transporter. They are essential in the treatment of neuropsychiatric and neurological disorders, such as schizophrenia, bipolar disorder, and major depressive disorder.
3. Used in Chemical Research:
1-(3-Chloropropoxy)-4-fluorobenzene's unique chemical structure and properties make it a valuable compound for research purposes. It can be used to explore new synthetic pathways, develop novel chemical reactions, and create innovative materials with potential applications in various industries.

InChI:InChI=1/C9H10ClFO/c10-6-1-7-12-9-4-2-8(11)3-5-9/h2-5H,1,6-7H2

Upstream product

• 371-41-5 4-Fluorophenol 
• 142-28-9 1,3-Dichloropropane 
• 109-70-6 1.3-chlorobromopropane 

Downstream Products

• 56152-14-8 N-{2-(2-ethoxyphenoxy)ethyl}-3-(4-fluorophenoxy)propylamine hydrochloride 
• 203511-18-6 1-Fluoro-4-propoxy-benzene 

Relevant articles and documents

Improved Potency of Indole-Based NorA Efflux Pump Inhibitors: From Serendipity toward Rational Design and Development

The NorA efflux pump is a potential drug target for reversal of resistance to selected antibacterial agents, and recently we described indole-based inhibitor candidates. Herein we report a second class of inhibitors derived from them but with significant differences in shape and size. In particular, compounds 13 and 14 are very potent inhibitors in that they demonstrated the lowest IC50 values (2 μM) ever observed among all indole-based compounds we have evaluated.

Copper-Catalyzed Regioselective Hydroalkylation of 1,3-Dienes with Alkyl Fluorides and Grignard Reagents

Copper complexes generated in situ from CuCl2, alkyl Grignard reagents, and 1,3-dienes play important roles as catalytic active species for the 1,2-hydroalkylation of 1,3-dienes by alkyl fluorides through C-F bond cleavage. The alkyl group is introduced to an internal carbon atom of the 1,3-diene regioselectively, thus giving rise to the branched terminal alkene product. Making the switch: A copper-hydride species, generated by the treatment of a copper salt with alkyl Grignard reagents, catalyzes the 1,2-hydroalkylation of 1,3-dienes by alkyl fluorides and Grignard reagents. The alkyl group of the alkyl fluoride is selectively introduced to an internal carbon atom of the 1,3-diene and the Grignard reagent acts as hydride source to give the branched terminal alkene, even in the presence of alkenes and alkynes.

Novel cyclic amide derivatives

Novel compounds represented by the following formula (I) that act as a ligand to sigma receptor/binding cite and a medicament comprising the same as an active ingredient: wherein X represents an alkyl group, an aryl group, a heterocyclic group or the like; Q represents a group represented by —CH2—, —CO—, —O—, —CH(OR7)— or the like wherein R7 represents a hydrogen atom, an alkyl group or the like; n represents an integer of from 0 to 5; R1 and R2 each represent a hydrogen atom, an alkyl group or the like; B represents either of the following groups: wherein R3, R4, R5, and R6 each represent a hydrogen atom, a halogen atom, an alkoxyl group or the like; m represents 1 or 2; and the ring of: represents an aromatic heterocyclic ring.