1000895-54-4

Basic information

• Product Name: 5-(3,5-diMethoxyphenyl)-3-oxopentanenitrile
• Synonyms: 5-(3,5-diMethoxyphenyl)-3-oxopentanenitrile;3,5-Dimethoxy-b-oxo-benzenepentanenitrile
• CAS NO: 1000895-54-4
• Molecular Formula: C₁₃H₁₅NO₃
• Molecular Weight: 233
• Mol File: 1000895-54-4.mol
• Article Data: 10

Chemical Properties

• Boiling Point: 374.2±32.0 °C(Predicted)
• Appearance: /
• Density: 1.109±0.06 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• PKA: 9.76±0.10(Predicted)
• CAS DataBase Reference: 5-(3,5-diMethoxyphenyl)-3-oxopentanenitrile(CAS DataBase Reference)
• NIST Chemistry Reference: 5-(3,5-diMethoxyphenyl)-3-oxopentanenitrile(1000895-54-4)
• EPA Substance Registry System: 5-(3,5-diMethoxyphenyl)-3-oxopentanenitrile(1000895-54-4)

Safety Data

• Hazardous Substances Data: 1000895-54-4(Hazardous Substances Data)

Usage

General Description

5-(3,5-Dimethoxyphenyl)-3-oxopentanenitrile is a chemical compound with the molecular formula C13H15NO4. It is a nitrile compound that contains a phenyl group substituted with two methoxy groups, as well as a carbonyl group and a nitrile group. 5-(3,5-Dimethoxyphenyl)-3-oxopentanenitrile is often used in organic synthesis as a building block for the preparation of various pharmaceuticals and other organic compounds. It has also been studied for its potential biological activities, including its antibacterial and antifungal properties. Additionally, its structure and reactivity make it a useful intermediate in the synthesis of more complex organic molecules.

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Downstream Products

• 1000895-53-3 3-(3,5-dimethoxyphenylethyl)-1H-pyrazol-5-amine 

Relevant articles and documents

A Naphthalimide-Based ND-O-EAc Photocatalyst for Sulfonation of Alkenes to Access β-Ketosulfones Under Visible Light

The development of facile, efficient, cost-effective, and visible light-driven photocatalysts for organic synthetic chemistry has received increasing attention. This protocol has initially synthesized a naphthalimide-based ND-O-EAc visible light photocatalyst for the sulfonation of alkenes to produce β-ketosulfones. Compared with the current photosynthetic strategies, the newly developed catalytic system has some merits, namely high efficiency, gram-scale preparation of low-cost photocatalyst, no metal contamination, wide substrate scope, and green terminal oxidant of air. Moreover, the prepared photocatalyst of ND-O-EAc is feasible for the sulfonation reactions of androstenones. Importantly, such a photocatalysis strategy can easily realize the scale-up synthesis for β-ketosulfone drugs under the mild conditions up to 90 % yield.

Vinyl sulfamido substituted pyrazolyl benzamide compound

The invention provides a vinyl sulfamide substituted pyrazolyl benzamide compound. Specifically, the present invention provides a compound in formula I shown in the specification or a pharmaceuticallyacceptable salt thereof, and a preparation method and use thereof. The compound shown in the formula I has excellent FGFR inhibitory activity and can be used for preventing or treating diseases related to FGFR kinase activity or expression quantity, such as cancer.

Method for preparing AZD4547, intermediate and preparation method of intermediate

The invention provides a method for preparing AZD-4547. The method comprises the following steps: (1) preparing a first intermediate 2-cyano-5-(3, 5-dimethoxyphenyl)-3-oxoethyl valerate; (2) preparinga second intermediate 5-[2-(3, 5-dimethoxyphenyl) ethyl]-1H-pyrazole-3-amine by taking the first intermediate as a raw material; and (3) in an alkali-containing organic solvent, carrying out a reaction on a third intermediate 4-((3S, 5R)-3, 5-dimethylpiperazinyl-1-yl) benzoyl chloride and the second intermediate to prepare the AZD-4547. The method has the advantages of accessible raw materials, simple technique, mild reaction conditions, convenient operation, high yield and low cost and can easily implement industrial production. The invention also provides an intermediate 2-cyano-5-(3, 5-dimethoxyphenyl)-3-oxoethyl valerate for preparing AZD-4547 and a preparation method thereof.