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The chemical compound "4-{[4-(diethylamino)benzylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione" is a complex organic molecule with a molecular formula of C20H23N7S. It features a 1,2,4-triazole core, which is a five-membered ring containing three nitrogen atoms and one sulfur atom. The molecule has a 5-methyl-1H-pyrazol-3-yl group attached to the 5-position of the triazole ring, providing a methyl-substituted pyrazole moiety. Additionally, it contains a 4-(diethylamino)benzylidene group, which is a benzylidene moiety with a diethylamino substituent at the 4-position. 4-{[4-(diethylamino)benzylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione is characterized by its unique structure and potential applications in various fields, such as pharmaceuticals or materials science, due to its diverse functional groups and potential for molecular interactions.

4809-04-5

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4809-04-5 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4809-04-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,8,0 and 9 respectively; the second part has 2 digits, 0 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 4809-04:
(6*4)+(5*8)+(4*0)+(3*9)+(2*0)+(1*4)=95
95 % 10 = 5
So 4809-04-5 is a valid CAS Registry Number.

4809-04-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-[[4-(diethylamino)phenyl]methylideneamino]-3-(5-methyl-1H-pyrazol-3-yl)-1H-1,2,4-triazole-5-thione

1.2 Other means of identification

Product number -
Other names 4-{[4-(diethylamino)benzylidene]amino}-5-(5-methyl-1H-pyrazol-3-yl)-2,4-dihydro-3H-1,2,4-triazole-3-thione

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:4809-04-5 SDS

4809-04-5Downstream Products

4809-04-5Relevant academic research and scientific papers

Rh(III)-catalyzed C-H activation/cyclization of benzamides and diazo compounds to form isocoumarins and α-pyrones

Li, Xing Guang,Sun, Min,Liu, Kai,Jin, Qiao,Liu, Pei Nian

, p. 2380 - 2383 (2015)

Rhodium-catalyzed intermolecular cyclization of benzamides and diazo compounds via C-H activation has been achieved to construct C-C/C-O bonds for the first time. The process provides a facile approach for the construction of isocoumarins and α-pyrones wi

Rh(III)-catalyzed annulation of BOC-protected benzamides with diazo compounds: Approach to isocoumarins

Dong, Guangyu,Li, Chunpu,Liu, Hong

, (2019/04/02)

A mild rhodium-catalyzed annulation of Boc-protected benzamides with diazo compounds via C?C/C?O bond formation has been explored. In the presence of [Cp*RhCl2]2, AgSbF6 and Cs2CO3, Boc-protected benzamides can be effectively annulated to yield isocoumarins in 0.5–2 h.

Synthesis of isocoumarins via silver(I)-mediated annulation of enol esters

Panda, Niranjan,Mishra, Priyadarshini,Mattan, Irshad

, p. 1047 - 1056 (2016/02/19)

Silver-mediated annulation of 2-iodo enol esters leading to 4- and 3,4-substituted isocoumarins was accomplished selectively at room temperature. Coupling of 2-iodo benzoic acids with enolates that were produced in situ from the simple esters was also performed to produce isocoumarins under analogous reaction conditions. Owing to the mildness of the current protocol, 4-acyl 3-substituted isocoumarins were efficiently produced without any deacylation.

Ortho-Induced transition-metal-free C-arylation cyclization reaction for the synthesis of polysubstituted isocoumarins

Liu, Lei,Hu, Jie,Wang, Xiang-Chuan,Zhong, Mei-Jin,Liu, Xue-Yuan,Yang, Shang-Dong,Liang, Yong-Min

supporting information; experimental part, p. 5391 - 5395 (2012/09/08)

A new protocol for the synthesis of polysubstituted isocoumarins from 2-iodobenzoic acid and β-diketone compounds has been developed. The occurrence of C-arylation cyclization reaction in transition-metal-free systems and ortho-induced substrates has been exploited. Reactions using these inexpensive conditions have displayed high functional group tolerance and excellent yields.

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