53553-14-3

Basic information

• Product Name: METHYL 2-CHLORO-3-NITROBENZOATE
• Synonyms: METHYL 2-CHLORO-3-NITROBENZOATE;Benzoic acid, 2-chloro-3-nitro-, methyl ester
• CAS NO: 53553-14-3
• Molecular Formula: C₈H₆ClNO₄
• Molecular Weight: 215.59
• Product Categories: Aromatic Esters
• Mol File: 53553-14-3.mol
• Article Data: 31

Chemical Properties

• Boiling Point: 319.531 °C at 760 mmHg
• Flash Point: 147.047 °C
• Appearance: /
• Density: 1.427 g/cm³
• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.568
• Storage Temp.: 2-8°C
• CAS DataBase Reference: METHYL 2-CHLORO-3-NITROBENZOATE(CAS DataBase Reference)
• NIST Chemistry Reference: METHYL 2-CHLORO-3-NITROBENZOATE(53553-14-3)
• EPA Substance Registry System: METHYL 2-CHLORO-3-NITROBENZOATE(53553-14-3)

Safety Data

• Hazardous Substances Data: 53553-14-3(Hazardous Substances Data)

Usage

Description

METHYL 2-CHLORO-3-NITROBENZOATE, with the molecular formula C8H6ClNO4, is a yellow crystalline chemical compound that serves as an intermediate in the synthesis of various organic chemicals, including pharmaceuticals and agrochemicals. It is primarily used in the production of other chemicals and does not have many direct applications of its own. Due to its hazardous properties, proper safety measures should be taken when handling it.

Uses

Used in Pharmaceutical Industry:
METHYL 2-CHLORO-3-NITROBENZOATE is used as a chemical intermediate for the synthesis of various pharmaceuticals. It plays a crucial role in the production of active pharmaceutical ingredients, contributing to the development of new drugs and therapies.
Used in Agrochemical Industry:
METHYL 2-CHLORO-3-NITROBENZOATE is used as a chemical intermediate in the synthesis of agrochemicals. It helps in the production of various agrochemicals, such as pesticides and herbicides, which are essential for crop protection and ensuring food security.
Used in Organic Chemical Synthesis:
METHYL 2-CHLORO-3-NITROBENZOATE is used as a key intermediate in the synthesis of other organic chemicals. Its unique chemical structure allows it to be a versatile building block for the creation of various organic compounds, expanding the scope of chemical research and development.

InChI:InChI=1/C8H6ClNO4/c1-14-8(11)5-3-2-4-6(7(5)9)10(12)13/h2-4H,1H3

Upstream product

• 67-56-1 methanol 
• 79-37-8 oxalyl dichloride 
• 3970-35-2 2-chloro-3-nitrobezoic acid 
• 75-09-2 dichloromethane 
• 247903-17-9 3-(3-carbomethoxy-2-chloroanilino)cyclohex-2-en-1-one 
• 2622-14-2 tricyclohexylphosphine 
• 34128-16-0 2-chloro-3-nitro-benzoyl chloride 
• 1445-45-0 Trimethyl orthoacetate 
• 18107-18-1 diazomethyl-trimethyl-silane 

Downstream Products

• 328546-65-2 9-nitro-1,2,3,4-tetrahydro-5H-1,4-benzodiazepin-5-one 
• 946126-94-9 2-fluoro-3-nitrobenzoic acid methyl ester 
• 1097196-70-7 methyl 2-[(4-chlorobenzyl)amino]-3-nitrobenzoate 
• 1195768-68-3 methyl 2-chloro-3-{[(2-propen-1-yloxy)carbonyl]amino}benzoate 
• 1307272-36-1 N-(2-chloro-3-(2-(2-chloropyrimidin-4-yl)acetyl)phenyl)propane-1-sulfonamide 
• 1307272-07-6 N-(3-(2-bromo-2-(2-chloropyrimidin-4-yl)acetyl)-2-chlorophenyl)propane-1-sulfonamide 
• 1307272-31-6 methyl 2-chloro-3-{[(3,3,3-trifluoropropyl)sulfonyl]amino}benzoate 
• 1307272-32-7 N-{2-chloro-3-[(2-chloro-4-pyrimidinyl)acetyl]phenyl}-3,3,3-trifluoro-1-propanesulfonamide 
• 1307272-35-0 methyl 2-chloro-3-[(propylsulfonyl)amino]benzoate 
• 1307272-64-5 N-(2-chloro-3-(5-(2-chloropyrimidin-4-yl)-2-(1-hydroxy-2-methylpropan-2-yl)thiazol-4-yl)phenyl)propane-1-sulfonamide 
• 1307272-41-8 N-{2-chloro-3-[5-(2-chloro-4-pyrimidinyl)-2-(tetrahydro-2H-pyran-4-yl)-1,3-thiazol-4-yl]phenyl}-1-propanesulfonamide 
• 1307271-14-2 N-{2-chloro-3-[5-{2-[(2-hydroxy-2-methylpropyl)amino]-4-pyrimidinyl}-2-(tetrahydro-2H-pyran-4-yl)-1,3-thiazol-4-yl]phenyl}-1-propanesulfonamide 
• 1307296-89-4 N-{2-chloro-3-[5-{2-[(2-hydroxyethyl)amino]-4-pyrimidinyl}-2-(tetrahydro-2H-pyran-4-yl)-1,3-thiazol-4-yl]phenyl}-1-propanesulfonamide 
• 1307272-73-6 1,1-dimethylethyl 4-[4-{2-chloro-3-[(propylsulfonyl)amino]phenyl}-5-(2-chloro-4-pyrimidinyl)-1,3-thiazol-2-yl]-1-piperidinecarboxylate 

Relevant articles and documents

From off-to on-target: New BRAF-inhibitor-template-derived compounds selectively targeting mitogen activated protein kinase kinase 4 (MKK4)

The mitogen-activated protein kinase (MAP) kinase 4 (MKK4) was found to be a major regulator of liver regeneration and could be a valuable drug target addressing liver related diseases by restoring its intrinsic regenerative capacity. We report on the synthesis and optimization of novel MKK4 inhibitors following a target-hopping strategy from the FDA-approved BRAFV600E inhibitor PLX4032 (8). Applying an iterative multi-parameter optimization process we carved out essential structural features yielding in compounds with a low nanomolar affinity for MKK4 and excellent selectivity profiles against the main off-targets MKK7 and JNK1, which, upon relevant inhibition, would totally abrogate the pro-regenerative effect of MKK4 inhibition, as well as against the off-targets MAP4K5, ZAK and BRAF with selectivity factors ranging from 40 to 430 for our best-balanced compounds 70 and 73.

COMPOUNDS, COMPOSITIONS AND METHODS OF USE

Herein, compounds, compositions and methods for modulating inclusion formation and stress granules in cells related to the onset of neurodegenerative diseases, musculoskeletal diseases, cancer, ophthalmological diseases, and viral infections are described.

PROTEIN KINASE INHIBITORS FOR PROMOTING LIVER REGENERATION OR REDUCING OR PREVENTING HEPATOCYTE DEATH

The invention relates to MKK4 (mitogen-activated protein kinase 4) and their use in promoting liver regeneration or reducing or preventing hepatocyte death. The MKK4 inhibitors selectively inhibit protein kinase MKK4 over protein kinases JNK and MKK7.