68684-63-9

Basic information

• Product Name: 1-(4-hydroxyphenyl)-1,2-diphenyl-1-butene
• Synonyms: 1-(4-hydroxyphenyl)-1,2-diphenyl-1-butene;TAMOXIFENMETABOLITEE;4-(1,2-Diphenylbut-1-enyl)phenol;ICI 77949
• CAS NO: 68684-63-9
• Molecular Formula: C₂₂H₂₀O
• Molecular Weight: 300.3936
• Mol File: 68684-63-9.mol
• Article Data: 8

Chemical Properties

• Melting Point: 104-105℃
• Boiling Point: 420.6°Cat760mmHg
• Flash Point: 197.2°C
• Appearance: /
• Density: 1.096g/cm³
• Vapor Pressure: 1.13E-07mmHg at 25°C
• Refractive Index: 1.622
• PKA: 9.37±0.15(Predicted)
• CAS DataBase Reference: 1-(4-hydroxyphenyl)-1,2-diphenyl-1-butene(CAS DataBase Reference)
• NIST Chemistry Reference: 1-(4-hydroxyphenyl)-1,2-diphenyl-1-butene(68684-63-9)
• EPA Substance Registry System: 1-(4-hydroxyphenyl)-1,2-diphenyl-1-butene(68684-63-9)

Safety Data

• Hazardous Substances Data: 68684-63-9(Hazardous Substances Data)

Usage

General Description

1-(4-hydroxyphenyl)-1,2-diphenyl-1-butene is a chemical compound with a molecular structure consisting of a hydroxyphenyl group attached to a diphenylbutene moiety. It is categorized as a substituted stilbene compound, which means it contains a central stilbene core with a hydroxyphenyl group attached at one end. 1-(4-hydroxyphenyl)-1,2-diphenyl-1-butene may have potential applications in various fields including pharmaceuticals, dyes, and materials science due to its unique chemical structure and properties. However, it is important to note that further research and testing are needed to fully understand its potential uses and safety considerations.

InChI:InChI=1/C22H20O/c1-2-21(17-9-5-3-6-10-17)22(18-11-7-4-8-12-18)19-13-15-20(23)16-14-19/h3-16,23H,2H2,1H3/b22-21+

Upstream product

• 100-66-3 methoxybenzene 
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• 540-38-5 p-Iodophenol 
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Downstream Products

• 10540-29-1 tamoxifen 
• 13002-65-8 (E)-tamoxifen 
• 10540-29-1 tamoxifen 
• 97818-87-6 Z-1,2-diphenyl-1-<4-<2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenoxy>phenyl>-1-butene 
• 97818-88-7 E-1,2-diphenyl-1-<4-<2,3,5,6-tetrafluoro-4-(trifluoromethyl)phenoxy>phenyl>-1-butene 
• 749-16-6 3-[4-(1,2-diphenylbut-1-en-1-yl)phenoxy]-N,N-dimethylpropan-1-amine 

Relevant articles and documents

Peroxidase-mediated dealkylation of tamoxifen, detected by electrospray ionization-mass spectrometry, and activation to form DNA adducts

Tamoxifen (TAM) is extensively used for the treatment and prevention of breast cancer. Associated with TAM treatment is a two- to eightfold increase in risk of endometrial cancer. To understand the mechanisms associated with this increased risk several pa

Design and synthesis of norendoxifen analogues with dual aromatase inhibitory and estrogen receptor modulatory activities

Both selective estrogen receptor modulators and aromatase inhibitors are widely used for the treatment of breast cancer. Compounds with both aromatase inhibitory and estrogen receptor modulatory activities could have special advantages for treatment of br

Direct copper-catalyzed α-arylation of benzyl phenyl ketones with aryl iodides: Route towards tamoxifen

No activation needed: The first efficient method for direct α-arylation of non-activated or non-protected family of enolizable ketones with simple aryl iodides employs a catalytic copper system. The method shows potential for the easy and step-economical synthesis of tamoxifen, the most commonly administrated drug for the management of breast cancer. R, R′, R′′ = electron-donating or electron-withdrawing groups. Copyright