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Benzenecarboximidic acid, 4-nitro-, ethyl ester, also known as 4-Nitrobenzenecarboximidic acid, ethyl ester, is an organic compound with the chemical formula C9H10N2O4. It is a derivative of benzenecarboximidic acid, featuring a nitro group at the 4-position and an ethyl ester group. Benzenecarboximidic acid, 4-nitro-, ethyl ester is characterized by its yellow crystalline appearance and is soluble in organic solvents. It is primarily used as an intermediate in the synthesis of pharmaceuticals and other organic compounds. Due to its reactivity and potential health hazards, it is important to handle this chemical with care, following proper safety protocols.

831-68-5

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831-68-5 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 831-68-5 includes 6 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 3 digits, 8,3 and 1 respectively; the second part has 2 digits, 6 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 831-68:
(5*8)+(4*3)+(3*1)+(2*6)+(1*8)=75
75 % 10 = 5
So 831-68-5 is a valid CAS Registry Number.

831-68-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-nitro-benzimidic acid ethyl ester

1.2 Other means of identification

Product number -
Other names 4-Nitro-benzimidsaeure-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:831-68-5 SDS

831-68-5Relevant academic research and scientific papers

Sequential C-H activation enabled expedient delivery of polyfunctional arenes

Cai, Xiaoqing,Chen, Qian,Chen, Xiaojian,Gao, Yang,Huo, Yanping,Li, Xianwei,Ouyang, Wensen,Rao, Jianhang,Wang, Jie

supporting information, p. 8075 - 8078 (2021/08/20)

Modular construction of polyfunctional arenes from abundant feedstocks stands as an unremitting pursue in synthetic chemistry, accelerating the discovery of drugs and materials. Herein, using the multiple C-H activation strategy with versatile imidate esters, the expedient delivery of molecular libraries of densely functionalized sulfur-containing arenes was achieved, which enabled the concise construction of biologically active molecules, such as Bipenamol.

Benzimidates as gem-Diamidation and Amidoindolyzation Cascade Synthons with a Hydrated NiII Catalyst

Nandi, Rajesh,Mandal, Prakash K.,Kayet, Anirban,Bhattachariya, Tamalika,Ghosh, Sukla,Maiti, Dilip K.

supporting information, p. 3474 - 3478 (2020/04/20)

We contributed a new benzimidate chemistry through moisture-insensitive NiII/NiII-FeIII combo-catalysis for a simultaneous 2-3 bond-forming gem-diamidation and amidoindolyzation cascade reaction to construct symmetrical an

Preparation method of compound containing pyrimidine framework and its application

-

, (2018/04/03)

The invention relates to a pyrimidine compound shown in general formula I, its geometrical isomer and its pharmaceutical acceptable salt, solvent compound or prodrug, a preparation method and a drug composition containing the compound. A substituent group

Synthesis of Functionalized Indenones via Rh-Catalyzed C-H Activation Cascade Reaction

Lv, Ningning,Chen, Zhengkai,Liu, Yue,Liu, Zhanxiang,Zhang, Yuhong

supporting information, p. 2588 - 2591 (2017/05/24)

An efficient and expeditious protocol for the synthesis of diverse difunctionalized indenones through rhodium-catalyzed C-H activation and multistep cascade reaction of benzimidates and alkenes has been developed. The transformation involves the cleavage and formation of multiple bonds in one pot under mild reaction conditions, and Mn(OAc)2 plays an important role in the reaction.

Cobalt-Catalyzed Oxidant-Free Spirocycle Synthesis by Liberation of Hydrogen

Lv, Ningning,Liu, Yue,Xiong, Chunhua,Liu, Zhanxiang,Zhang, Yuhong

supporting information, p. 4640 - 4643 (2017/09/12)

The first example of oxidant-free cobalt-catalyzed synthesis of five-membered spirocycles is reported from benzimidates and maleimides utilizing nitrobenzene as promoter. In contrast to previously known cobalt-catalyzed oxidative C-H functionalization rea

A to prepare to aminobenzoic amidine hydrochloride method

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Paragraph 0040-0042, (2017/02/02)

The invention relates to the technical field of pharmaceutical chemistry and provides a method for preparing p-amino-benzamidine hydrochloride. The method comprises the following steps: (1) p-nitrobenzonitfile II undergoes an amidining reaction in an amidining reagent I to obtain an intermediate p-nitrobenzene methylenimine III; (2) the intermediate p-nitrobenzene methylenimine III undergoes an amidining reaction in an amidining reagent II to obtain p-nitrobenzamidine IV; and (3) under an acidic condition, p-nitrobenzamidine IV undergoes a reduction reaction in a reaction solvent II by the use of a reducing agent to obtain p-amino-benzamidine hydrochloride. In the step (1), the amidining reagent I is thionyl chloride, phosphorus trichloride or phosphorus pentachloride; in the step (2), the amidining reagent II is ammonium carbonate, ammonium bicarbonate or ammonium chloride; and in the step (3), the reaction solvent II is a mixed solvent of water and alcohols. The synthetic method provided by the invention is safe and simple and has advantages of high yield and good product quality. The preparation method of p-amino-benzamidine hydrochloride is suitable for industrial production.

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