92013-18-8

Basic information

• Product Name: 2-(4-BROMO-BENZYL)-MALONIC ACID
• Synonyms: 2-(4-BROMO-BENZYL)-MALONIC ACID
• CAS NO: 92013-18-8
• Molecular Formula: C₁₀H₉BrO₄
• Molecular Weight: 273.08006
• Mol File: 92013-18-8.mol
• Article Data: 10

Chemical Properties

• Melting Point: 148-150 °C(Solv: ligroine (8032-32-4))
• Boiling Point: 436.0±35.0 °C(Predicted)
• Appearance: /
• Density: 1.695±0.06 g/cm3(Predicted)
• PKA: 3.13±0.10(Predicted)
• CAS DataBase Reference: 2-(4-BROMO-BENZYL)-MALONIC ACID(CAS DataBase Reference)
• NIST Chemistry Reference: 2-(4-BROMO-BENZYL)-MALONIC ACID(92013-18-8)
• EPA Substance Registry System: 2-(4-BROMO-BENZYL)-MALONIC ACID(92013-18-8)

Safety Data

• Hazardous Substances Data: 92013-18-8(Hazardous Substances Data)

Usage

Chemical Class

Benzylmalonic acids

Derivative

Malonic acid

Functionality

Bromo group in the benzyl ring

Usage

Preparation of organic compounds (pharmaceuticals, agrochemicals)

Importance

Valuable building block in organic synthesis

Reactivity

Unique structure and reactivity

Application

Starting material for complex organic molecules preparation

Upstream product

• 157134-36-6 dimethyl 2-(4-bromobenzyl)malonate 
• 589-17-3 p-bromobenzyl chloride 
• 589-15-1 1-bromomethyl-4-bromobenzene 
• 70146-78-0 diethyl 2-(4-bromobenzyl)malonate 

Downstream Products

• 1200-07-3 trans-4-bromocinnamic acid 
• 14091-15-7 p-bromo-DL-phenylalanine 
• 1643-30-7 3-(4-bromophenyl)propionic acid 
• 607744-33-2 3-(4-bromophenyl)-1-morpholinopropan-1-one 
• 607744-36-5 4-(3-(4-bromophenyl)propyl)morpholine 
• 27465-66-3 4-bromocinnamoyl chloride 
• 75476-78-7 5-bromo-1H-indene 
• 75476-86-7 6-Bromo-2,3-dihydro-1H-inden-1-ol 
• 52689-24-4 5-Ethylindan 
• 7480-80-0 5-methyl-1H-indene 
• 351014-59-0 vinyl 3-(4-bromophenyl)propanoate 
• 55394-81-5 3-(4-bromophenyl)propanoyl chloride 
• 14548-39-1 6-bromoindan-1-one 

Relevant articles and documents

Synthesis and insecticidal activity of mesoionic pyrido[1,2-α]pyrimidinone derivatives containing a neonicotinoid moiety

Mesoionic pyrido[1,2-α]pyrimidinone derivatives containing a neonicotinoid moiety were designed, synthesized, and evaluated for their insecticidal activity. Some of the title compounds showed remarkable insecticidal properties against Aphis craccivora. Compound I13 exhibited satisfactory insecticidal activity against A. craccivora. Meanwhile, label-free proteomics analysis of compound I13 treatment identified a total of 821 proteins. Of these, 35 proteins were up-regulated, whereas 108 proteins were down-regulated. Differential expressions of these proteins reflected a change in cellular structure and metabolism.

SUBSTITUTED BENZAMIDES AND THEIR USES

Provided herein are Substituted Benzamides, compositions, and method of their manufacture and use.

Design and synthesis of novel lactate dehydrogenase a inhibitors by fragment-based lead generation

Lactate dehydrogenase A (LDHA) catalyzes the conversion of pyruvate to lactate, utilizing NADH as a cofactor. It has been identified as a potential therapeutic target in the area of cancer metabolism. In this manuscript we report our progress using fragment-based lead generation (FBLG), assisted by X-ray crystallography to develop small molecule LDHA inhibitors. Fragment hits were identified through NMR and SPR screening and optimized into lead compounds with nanomolar binding affinities via fragment linking. Also reported is their modification into cellular active compounds suitable for target validation work.