7390-42-3

Basic information

• Product Name: 2-CHLORO-4-METHYLBENZONITRILE
• CAS NO: 7390-42-3
• Molecular Formula: C₇H₁₃NS
• Molecular Weight: 151.59
• Product Categories: Aromatic Nitriles
• Mol File: 7390-42-3.mol
• Article Data: 15

Chemical Properties

• Melting Point: 116 °C
• Boiling Point: 238.5±23.0 °C(Predicted)
• Appearance: /
• Density: 1.079±0.06 g/cm3(Predicted)
• PKA: 13.12±0.20(Predicted)
• CAS DataBase Reference: 2-CHLORO-4-METHYLBENZONITRILE(CAS DataBase Reference)
• NIST Chemistry Reference: 2-CHLORO-4-METHYLBENZONITRILE(7390-42-3)
• EPA Substance Registry System: 2-CHLORO-4-METHYLBENZONITRILE(7390-42-3)

Safety Data

• Hazard Codes: Xi
• Hazardous Substances Data: 7390-42-3(Hazardous Substances Data)

Upstream product

• 1122-56-1 cyclohexylcarboxamide 
• 766-05-2 cyclohexane carbonitrile 

Downstream Products

• 62925-40-0 4-(4-chloro-phenyl)-6-cyclohexyl-2,2-diphenyl-4H-[1,3,5]dithiazine 
• 41795-20-4 N-Acetyl-thiocyclohexancarbonsaeureamid 
• 42123-83-1 N-Cyclohexanecarbothioyl-2-phenyl-acetamide 
• 63523-41-1 Cyclohexanecarbothioic acid (methoxy-phenyl-methyl)-amide 
• 63523-42-2 Cyclohexanecarbothioic acid (cyclohexyl-methoxy-methyl)-amide 
• 24087-96-5 ethyl 2-(2-cyclohexyl-4-thiazolyl)acetate 
• 923605-07-6 ethyl 2-cyclohexylthiazole-4-carboxylate 
• 1318795-42-4 2-cyclohexyl-5,6-dihydro-4H-1,3-thiazine 
• 1240737-18-1 C₇H₁₃NS*C₁₂H₁₀OS 
• 1229016-92-5 4-(2-cyclohexylthiazol-4-yl)nitrobenzene 
• 1448866-08-7 2-cyclohexyl-4-hydroxymethylthiazole 
• 66493-02-5 chloromethyl-2-cyclohexyl-thiazole 
• 1628755-58-7 C₁₆H₂₁ClN₂S 
• 1036470-11-7 C₁₄H₁₇ClN₂S 

Relevant articles and documents

HPK1 INHIBITORS, PREPARATION METHOD AND APPLICATION THEREOF

Disclosed are HPK-1 inhibitors having a structure represented by Formula (X), pharmaceutical compositions comprising the HPK-1 inhibitors, methods of using the HPK-1 inhibitors, such as treating cancers, methods of preparing the HPK-1 inhibitors, and the synthetic intermediates.

Agonists for the adenosine A1 receptor with tunable residence time. a case for nonribose 4-amino-6-aryl-5-cyano-2-thiopyrimidines

We report the synthesis and evaluation of previously unreported 4-amino-6-aryl-5-cyano-2-thiopyrimidines as selective human adenosine A 1 receptor (hA1AR) agonists with tunable binding kinetics, this without affecting their nanomolar affinity for the target receptor. They show a very diverse range of kinetic profiles (from 1 min (compound 52) to 1 h (compound 43)), and their structure-affinity relationships (SAR) and structure-kinetics relationships (SKR) were established. When put in perspective with the increasing importance of binding kinetics in drug discovery, these results bring new evidence of the consequences of affinity-only driven selection of drug candidates, that is, the potential elimination of slightly less active compounds that may display preferable binding kinetics.

Microwave-assisted synthesis of potent PDE7 inhibitors containing a thienopyrimidin-4-amine scaffold

A series of novel thienopyrimidin-4-amines have been synthesized and evaluated as phosphodiesterase (PDE) inhibitors. A rationale for the observed selectivity against PDE7 has been obtained from molecular modelling studies on the most active compounds. This journal is the Partner Organisations 2014.