55241-49-1

Basic information

• Product Name: 1,3-DIMETHYL-2-OXO-2,3-DIHYDRO-1H-BENZIMIDAZOLE-5-CARBALDEHYDE
• Synonyms: 1,3-DIMETHYL-2-OXO-2,3-DIHYDRO-1H-BENZIMIDAZOLE-5-CARBALDEHYDE;1,3-DIMETHYL-2-OXO-2,3-DIHYDRO-1H-BENZOIMIDAZOLE-5-CARBALDEHYDE;TIMTEC-BB SBB010828;1,3-diMethyl-2-oxo-2,3-dihydro-1H-benzo[d]iMidazole-5-carbaldehyde;1,3-dimethyl-2-oxo-5-benzimidazolecarboxaldehyde;1,3-dimethyl-2-oxo-benzimidazole-5-carbaldehyde;1,3-dimethyl-2-oxobenzimidazole-5-carbaldehyde;2-keto-1,3-dimethyl-benzimidazole-5-carbaldehyde
• CAS NO: 55241-49-1
• Molecular Formula: C₁₀H₁₀N₂O₂
• Molecular Weight: 190.2
• Mol File: 55241-49-1.mol
• Article Data: 2

Chemical Properties

• Boiling Point: 325.5°C at 760 mmHg
• Flash Point: 148.8°C
• Appearance: /
• Density: 1.278g/cm³
• Vapor Pressure: 0.00023mmHg at 25°C
• Refractive Index: 1.625
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• PKA: -2.13±0.20(Predicted)
• CAS DataBase Reference: 1,3-DIMETHYL-2-OXO-2,3-DIHYDRO-1H-BENZIMIDAZOLE-5-CARBALDEHYDE(CAS DataBase Reference)
• NIST Chemistry Reference: 1,3-DIMETHYL-2-OXO-2,3-DIHYDRO-1H-BENZIMIDAZOLE-5-CARBALDEHYDE(55241-49-1)
• EPA Substance Registry System: 1,3-DIMETHYL-2-OXO-2,3-DIHYDRO-1H-BENZIMIDAZOLE-5-CARBALDEHYDE(55241-49-1)

Safety Data

• Statements: 36
• Safety Statements: 26
• HazardClass: IRRITANT
• Hazardous Substances Data: 55241-49-1(Hazardous Substances Data)

Usage

Uses

1,3-Dimethyl-2-oxo-5-benzimidazolinecarboxaldehyde is a useful reagent for synthesis and study of in vitro p38 structure acitivity of benzimidazolone inhibitors.

InChI:InChI=1/C10H10N2O2/c1-11-8-4-3-7(6-13)5-9(8)12(2)10(11)14/h3-6H,1-2H3

Upstream product

• 3097-21-0 1,3-dimethyl-1,3-dihydrobenzimidazol-2-one 
• 4885-02-3 Dichloromethyl methyl ether 
• 222424-21-7 methyl 1,3-dimethyl-2-oxo-2,3-dihydro-1H-benzo[d]imidazole-5-carboxylate 
• 345657-96-7 5-(hydroxymethyl)-1,3-dimethylbenzimidazol-2-one 

Downstream Products

• 1428968-43-7 5-(2-(1H-indol-3-yl)-1-((3-methoxyphenyl)amino)-2-oxoethyl)-1,3-dimethyl-1H-benzo[d]imidazol-2(3H)-one 

Relevant articles and documents

Benzimidazolone p38 inhibitors

The synthesis and in vitro p38α activity of a novel series of benzimidazolone inhibitors is described. The p38α SAR is consistent with a mode of binding wherein the benzimidazolone carbonyl serves as the H-bond acceptor to Met109 of p38α in a manner analogous to the pyridine nitrogen of prototypical pyridylimidazole p38 inhibitors. Potent p38α activity comparable to that of several previously reported p38 inhibitors is observed for this novel chemotype.