55044-96-7

Basic information

• Product Name: (4-TERT-BUTYLPHENYL)(4-HYDROXYPHENYL)METHANONE
• Synonyms: (4-TERT-BUTYLPHENYL)(4-HYDROXYPHENYL)METHANONE
• CAS NO: 55044-96-7
• Molecular Formula: C₁₇H₁₈O₂
• Molecular Weight: 254.3236
• Mol File: 55044-96-7.mol
• Article Data: 6

Chemical Properties

• Melting Point: 130–131°C
• Boiling Point: 404.9°Cat760mmHg
• Flash Point: 172.9°C
• Appearance: /
• Density: 1.093g/cm³
• Vapor Pressure: 3.91E-07mmHg at 25°C
• Refractive Index: 1.569
• CAS DataBase Reference: (4-TERT-BUTYLPHENYL)(4-HYDROXYPHENYL)METHANONE(CAS DataBase Reference)
• NIST Chemistry Reference: (4-TERT-BUTYLPHENYL)(4-HYDROXYPHENYL)METHANONE(55044-96-7)
• EPA Substance Registry System: (4-TERT-BUTYLPHENYL)(4-HYDROXYPHENYL)METHANONE(55044-96-7)

Safety Data

• Hazardous Substances Data: 55044-96-7(Hazardous Substances Data)

Usage

Preparation

Preparation by reaction of p-tert-butylbenzoyl chloride with phenol in the presence of aluminium chloride.

InChI:InChI=1/C17H18O2/c1-17(2,3)14-8-4-12(5-9-14)16(19)13-6-10-15(18)11-7-13/h4-11,18H,1-3H3

Upstream product

• 66803-01-8 (4-(tert-butyl)phenyl)(4-methoxyphenyl)methanone 
• 772-38-3 4-tert-Butylphenylacetylene 
• 106-51-4 p-benzoquinone 
• 1710-98-1 p-tert-butyl benzoyl chloride 
• 100-66-3 methoxybenzene 
• 108-95-2 phenol 

Downstream Products

• 190726-52-4 Ki₆₈₉₆ 
• 129051-12-3 2-[4-(4-tert-Butyl-benzoyl)-phenoxy]-propionic acid 

Relevant articles and documents

Visible Light-Mediated [2 + 2] Cycloaddition Reactions of 1,4-Quinones and Terminal Alkynes

A single-step synthesis of 4-hydroxy-functionalized bi-aryl and aryl/alkyl ketones via oxidative coupling of terminal alkynes with benzoquinones is reported. Furthermore, with naphthoquinones, owing to the cross-resonance of carbonyl with the aromatic ring, alkene-alkyne cycloaddition is more favored to give four-membered carbocyclic adducts, thereby precluding the requirement of preactivated alkynes.

Synthesis and structure-activity relationship for new series of 4-phenoxyquinoline derivatives as specific inhibitors of platelet-derived growth factor receptor tyrosine kinase

We discovered a new series of 4-phenoxyquinoline derivatives as potent and selective inhibitors of the platelet-derived growth factor receptor (PDGFr) tyrosine kinase. We researched the highly potent and selective inhibitors on the basis of both PDGFr and epidermal growth factor receptor (EGFr) inhibitory activity. First, we found a compound, Ki6783 (1), which inhibited PDGFr autophosphorylation at 0.13 μM, but it did not inhibit EGFr autophosphorylation at 100 μM. After extensive explorations, we found the two desired compounds, Ki6896 (2) and Ki6945 (3), which are substituted by benzoyl and benzamide at the 4-position of the phenoxy group on 4-phenoxyquinoline, respectively. These inhibitory activities were 0.31 and 0.050 μM, respectively, but neither of them inhibited EGFr autophosphorylation at 100 μM. We further investigated the profile of both compounds toward various tyrosine and serine/threonine kinases. The three compounds specifically inhibited PDGFr rather than the other kinases.

Quinoline and quinazoline derivatives inhibiting platelet-derived growth factor receptor autophosphorylation and pharmaceutical compositions containing the same

The present invention relates to novel quinoline derivatives and quinazoline derivatives represented by the following formula (I): STR1 [wherein R 1 and R 2 are each independently H or C 1 -C 4 -alkyl, or R 1 and R 2 together form C 1 -C 3 -alkylene, X is O, S or CH 2, W is CH or N, and Q is a substituted aryl group or substituted heteroaryl group] and their pharmaceutically acceptable salts, having platelet-derived growth factor receptor autophosphorylation inhibitory activity, to pharmaceutical compositions containing these compounds, and to methods for the treatment of diseases associated with abnormal cell growth such as tumors.