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N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide, also known as Dimethylcyclohexadienylideneacetamide, is a chemical compound with the molecular formula C11H13NO2. It is a yellow solid with a melting point of 94-96 °C. N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide is often used in organic synthesis and pharmaceutical research as a building block in the production of various drugs and other compounds. It is also known for its potential anti-inflammatory and analgesic properties, making it a target for drug development. Additionally, it has been studied for its potential antimicrobial and antifungal activities. However, it is important to handle N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide with care as it can be hazardous if not properly managed.

74827-85-3

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74827-85-3 Usage

Uses

Used in Pharmaceutical Research:
N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide is used as a building block in pharmaceutical research for the development of various drugs and compounds. Its unique chemical structure allows for the creation of a wide range of pharmaceutical products.
Used in Organic Synthesis:
N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide is also used in organic synthesis, where it serves as a key intermediate in the production of various organic compounds.
Used in Anti-inflammatory and Analgesic Applications:
Due to its potential anti-inflammatory and analgesic properties, N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide is used as a target for drug development in the treatment of pain and inflammation.
Used in Antimicrobial and Antifungal Applications:
N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide has been studied for its potential antimicrobial and antifungal activities, making it a candidate for use in applications targeting the prevention and treatment of infections caused by bacteria and fungi.

Check Digit Verification of cas no

The CAS Registry Mumber 74827-85-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,4,8,2 and 7 respectively; the second part has 2 digits, 8 and 5 respectively.
Calculate Digit Verification of CAS Registry Number 74827-85:
(7*7)+(6*4)+(5*8)+(4*2)+(3*7)+(2*8)+(1*5)=163
163 % 10 = 3
So 74827-85-3 is a valid CAS Registry Number.
InChI:InChI=1/C10H11NO2/c1-6-4-9(11-8(3)12)5-7(2)10(6)13/h4-5H,1-3H3

74827-85-3 Well-known Company Product Price

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  • Sigma-Aldrich

  • (51937)  N-Acetyl-3,5-dimethyl-4-benzoquinone imine  analytical standard

  • 74827-85-3

  • 51937-25MG

  • 1,547.91CNY

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74827-85-3SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 18, 2017

Revision Date: Aug 18, 2017

1.Identification

1.1 GHS Product identifier

Product name N-(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)acetamide

1.2 Other means of identification

Product number -
Other names 3.5-Dijod-O'-methyl-N-acetyl-L-thyronin-aethylester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:74827-85-3 SDS

74827-85-3Relevant academic research and scientific papers

Reaction of N-acetyl- and N-[1-(arylsulfonylimino)ethyl]-1,4-benzoquinone imines with sodium arenesulfinates

Konovalova,Avdeenko,Pirozhenko,Ledeneva,Santalova

, p. 1283 - 1291 (2015/01/09)

N-Acetyl- and N-[1-(arylsulfonylimino)ethyl]-1,4-benzoquinone imines having no substituent in the 2- and/or 6-position of the quinoid ring react with sodium arenesulfinates preferentially according to the 1,4-addition pattern. The presence of an ArSO

DPPH radical scavenging activity of paracetamol analogues

Alisi, Maria Alessandra,Brufani, Mario,Cazzolla, Nicola,Ceccacci, Francesca,Dragone, Patrizia,Felici, Marco,Furlotti, Guido,Garofalo, Barbara,La Bella, Angela,Lanzalunga, Osvaldo,Leonelli, Francesca,Marini Bettolo, Rinaldo,Maugeri, Caterina,Migneco, Luisa Maria,Russo, Vincenzo

, p. 10180 - 10187 (2013/01/15)

Biochemical studies suggest a direct relationship between the radical scavenging activity of paracetamol (I) and its antipyretic and analgesic action. To evaluate the effect of chemical modifications on the radical scavenging activity of compounds of type I, analogues 1-14 were prepared and submitted to a stable free radical (DPPH; 1,1-diphenyl-2-picryl-hydrazyl) assay. All paracetamol derivatives showed a significant higher efficiency than the parent compound. This study showed that radical scavenging activity can be increased by decreasing the phenolic ortho substituents steric hindrance or by introducing substituents on the acyl moiety like an indazole ring or the ionic N-methyl morpholinium group. A significant activating effect was also observed by replacing the 1,4-acylamidophenol with a 1,4-acylamidonaphthol system.

Rat liver microsomal cytochrome P450-dependent oxidation of 3,5-disubstituted analogues of paracetamol

Bessems,Te Koppele,Van Dijk,Van Stee,Commandeur,Vermeulen

, p. 647 - 666 (2007/10/03)

1. The cytochrome P450-dependent binding of paracetamol and a series of 3,5-disubstituted paracetamol analogues (R = -F, -Cl, -Br, -I, -C(H)3, -C2H5, -iC3H7) have been determined with β-naphthoflavone (βNF)-induced rat liver microsomes and produced reverse type I spectral changes. K(s,app) varied from 0.14 mM for 3,5-diiC3H7-paracetamol to 2.8 mM for paracetamol. 2. All seven analogues underwent rat liver microsomal cytochrome P450-dependent oxidation, as reflected by the formation of GSSG in the presence of GSH. The GSSG-formation was increased in all cases upon pretreatment of rats by β-naphthoflavone (βNF) and was generally decreased upon pretreatment by phenobarbital (PB). 3. Rat liver microsomal cytochrome P450 as well as horseradish peroxidase catalysed the formation of 3,5-disubstituted NAPQI analogues from the corresponding parent compounds, as identified by UV-spectrophotometry of the NAPQI analogues and by GC/MS detection of the following GSH-conjugates: 2-glutathione-S-yl-3,5-dimethyl-1,4-dihydroxybenzene, 2-glutathione-S-yl-3,5-dichloro-paracetamol, and 2-glutathione-S-yl-3,5-dibromo-paracetamol. 4. In liver microsomal (βNF-induced) incubations, apparent K(m) values, as determined for the cytochrome P450 catalysis-dependent oxidation of GSH, for seven 3,5-disubstituted paracetamol analogues (R = -F, -Cl, -Br, -I, -CH3, -C2H5, iC3H7) varied from 0.07 to 0.64 mM. Paracetamol exhibited an apparent K(m) of 0.73 mM. Apparent V(max) values for the cytochrome P450 catalysis dependent oxidation of GSH varied from 0.66 nmol min-1 mg-1 protein for paracetamol to 3.0 nmol min-1 mg-1 protein for 3,5-dimethyl-paracetamol.

Studies on the mechanism of toxicity of acetaminophen. Synthesis and reactions of N-acetyl-2,6-dimethyl- and N-acetyl-3,5-dimethyl-p-benzoquinone imines

Fernando,Calder,Ham

, p. 1153 - 1158 (2007/10/02)

N-Acetyl-2,6-dimethyl-p-benzoquinone imine and N-acetyl-3,5-dimethyl-p-benzoquinone imine were prepared from 2,6-dimethylacetaminophen and 3,5-dimethylacetaminophen by oxidation with lead tetraacetate. Reaction of N-acetyl-2,6-dimethyl-p-benzoquinone imine with hydrochloric acid gave 3'-chloro-2',6'-dimethyl-4'-hydroxyacetanilide, whereas ethanethiol, aniline, and ethanol gave tetrahedral adducts resulting from addition to the imine carbon. Water gave 2,6-dimethyl-p-benzoquinone. With N-acetyl-3,5-dimethyl-p-benzoquinone imine, water and aniline gave substitution on the imine carbon, yielding 2,6-dimethyl-p-benzoquinone and 3,5-dimethyl-N-phenyl-p-benzoquinone imine, respectively. Ethanethiol gave 3',5'-dimethyl-2'-(ethylthio)-4'-hydroxyacetanilide. The toxicity of 2,6-dimethylacetaminophen and 3,5-dimethylacetaminophen was examined histologically in mice and rats. 3,5-Dimethylacetaminophen was slightly more nephrotoxic but showed a similar hepatotoxicity to acetaminophen. 2,6-Dimethylacetaminophen, like N-methylacetaminophen, showed very little tissue damage.

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