157738-49-3

Basic information

• Product Name: (Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5
• Synonyms: (Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5;(Z)-1-(2-Chloroethoxy)-4-(1,2-diphenyl-1-butenyl-3,3,4,4,4-d5)benzene
• CAS NO: 157738-49-3
• Molecular Formula: C₂₄H₂₃ClO
• Molecular Weight: 367.92
• Product Categories: Isotope Labeled Compounds;Intermediates & Fine Chemicals;Isotope Labelled Compounds;Pharmaceuticals
• Mol File: 157738-49-3.mol

Chemical Properties

• Melting Point: 103-105°C
• Boiling Point: 474.7°C at 760 mmHg
• Flash Point: 235.3°C
• Appearance: /
• Density: 1.123g/cm³
• Vapor Pressure: 1.01E-08mmHg at 25°C
• Refractive Index: 1.591
• Solubility: Chloroform, Dichlormethane, Ethanol, Methanol
• CAS DataBase Reference: (Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5(CAS DataBase Reference)
• NIST Chemistry Reference: (Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5(157738-49-3)
• EPA Substance Registry System: (Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5(157738-49-3)

Safety Data

• Hazardous Substances Data: 157738-49-3(Hazardous Substances Data)

Usage

Uses

1. Pharmaceutical Industry:
(Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5 is used as an intermediate in the synthesis of labeled Tamoxifen derivatives. Its role in this process is crucial for the development of new pharmaceutical compounds that can be used for various medical applications, particularly in the treatment of certain types of cancer.
2. Research and Development:
In the field of research and development, (Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5 can be utilized as a key compound for studying the properties and behavior of similar organic molecules. This can lead to the discovery of new compounds with potential applications in various industries, including pharmaceuticals, materials science, and chemical engineering.
3. Diagnostic Applications:
The compound may also find use in the development of diagnostic tools and techniques, particularly in the field of medical imaging. Labeled Tamoxifen derivatives, which (Z)-1-[4-(2-CHLOROETHOXYPHENYL)]-1,2-DIPHENYL-1-BUTENE-4,4,5,5,5-D5 helps to produce, can be used as markers or tracers in imaging studies to detect and monitor the progression of diseases, such as cancer.

InChI:InChI=1/C24H23ClO/c1-2-23(19-9-5-3-6-10-19)24(20-11-7-4-8-12-20)21-13-15-22(16-14-21)26-18-17-25/h3-16H,2,17-18H2,1H3/b24-23-/i1D3,2D2

Upstream product

• 622-86-6 2-chloroethoxybenzene 
• 157738-48-2 <3,3,4,4,4-2H5>-1-<4-(2-chloroethoxy)phenyl>-2-phenyl1-butanone 
• 19561-95-6 1-<4-(2-chloroethoxy)phenyl>-2-phenylethanone 
• 103-82-2 phenylacetic acid 

Downstream Products

• 157698-32-3 -tamoxifen 

Relevant articles and documents

Synthesis of -tamoxifen; A Mechanistic Probe of Tamoxifen Induced Hepatic DNA Adduct Formation

Tamoxifen which incorporates a fully deuterated ethyl group, 5-ethyl>-tamoxifen, has been synthesised in order to probe the mechanism of tamoxifen induced hepatic DNA adduct formation.The pentadeuteroethyl group was introduced into the tamoxi