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[(2-chlorophenyl)amino](oxo)acetic acid, also known as 2-chlorophenylglycine, is a synthetic compound with the molecular formula C8H7ClNO3. It is a derivative of glycine and contains a chlorophenyl group, an amino group, and a carboxylic acid group. This versatile chemical is characterized by its potential applications in various fields, including pharmaceuticals, agrochemicals, and other organic compounds.

77901-50-9

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77901-50-9 Usage

Uses

Used in Pharmaceutical Synthesis:
[(2-chlorophenyl)amino](oxo)acetic acid is used as an intermediate in the synthesis of pharmaceuticals for its unique structural properties. The presence of the chlorophenyl group and the amino group allows for the creation of a wide range of therapeutic compounds with diverse biological activities.
Used in Agrochemical Synthesis:
In the agrochemical industry, [(2-chlorophenyl)amino](oxo)acetic acid is used as a building block for the development of new agrochemicals. Its chemical structure can be modified to create compounds with specific pesticidal, herbicidal, or fungicidal properties, contributing to the control of various agricultural pests and diseases.
Used in Organic Chemistry:
[(2-chlorophenyl)amino](oxo)acetic acid serves as a versatile starting material in organic chemistry for the synthesis of various organic compounds. Its functional groups can be further modified or reacted with other molecules to produce a wide array of products with different applications in the chemical industry.
Used in Medical Research:
[(2-chlorophenyl)amino](oxo)acetic acid is used as a research compound for investigating its potential biological activities, such as antifungal and antibacterial properties. These studies may lead to the development of new treatments for various infections and diseases.
Used in the Treatment of Schizophrenia and Neurological Disorders:
In the medical field, [(2-chlorophenyl)amino](oxo)acetic acid is being explored for its potential use in the treatment of schizophrenia and neurological disorders. Its unique chemical structure may offer new therapeutic avenues for managing these complex conditions.

Check Digit Verification of cas no

The CAS Registry Mumber 77901-50-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 7,7,9,0 and 1 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 77901-50:
(7*7)+(6*7)+(5*9)+(4*0)+(3*1)+(2*5)+(1*0)=149
149 % 10 = 9
So 77901-50-9 is a valid CAS Registry Number.
InChI:InChI=1/C8H6ClNO3/c9-5-3-1-2-4-6(5)10-7(11)8(12)13/h1-4H,(H,10,11)(H,12,13)

77901-50-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 12, 2017

Revision Date: Aug 12, 2017

1.Identification

1.1 GHS Product identifier

Product name [(2-Chlorophenyl)amino](oxo)acetic acid

1.2 Other means of identification

Product number -
Other names Oxalsaeure-mono-(2-chlor-anilid)

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:77901-50-9 SDS

77901-50-9Relevant academic research and scientific papers

CASPASE INHIBITOR AND PHARMACEUTICAL COMPOSITION, USE AND THERAPEUTIC METHOD THEREOF

-

Paragraph 0629; 0631, (2019/04/05)

Disclosed are a class of compounds as a caspase inhibitor, and in particular the compound as shown in formula (I) or a pharmaceutically acceptable salt thereof, and the use of the compound in treating caspase-related diseases.

Structure-activity relationship study of a series of caspase inhibitors containing γ-amino acid moiety for treatment of cholestatic liver disease

Mou, Jianfeng,Wu, Songliang,Luo, Zhi,Guo, Fengying,He, Haiying,Wang, Jianhua,Lin, Fusen,Guo, Fengxun,Sun, Jianping,Shen, Liang,Zeng, Minggao,Wang, Chuan,Xu, Deming,Gu, Zhengxian,Tian, Xin,Zhang, Aiming,Xu, Hongjiang,Yang, Ling,Zhang, Xiquan,Li, Jian,Chen, Shuhui

supporting information, p. 1874 - 1878 (2018/04/12)

A series of caspase inhibitors containing γ-amino acid moiety have been synthesized. A systemic study on their structure-activity relationship of anti-apoptotic cellular activity is presented. These efforts led to the discovery of compound 20o as a potent caspase inhibitor, which demonstrated preclinical ameliorating total bilirubin efficacy with a significantly improved pharmacokinetic profile.

Synthesis, crystal structure, and insecticidal activity of novel N-alkyloxyoxalyl derivatives of 2-arylpyrrole

Zhao, Yu,Mao, Chunhui,Li, Yongqiang,Zhang, Pengxiang,Huang, Zhiqiang,Bi, Fuchun,Huang, Runqiu,Wang, Qingmin

experimental part, p. 7326 - 7332 (2010/06/11)

Two series of novel N-alkyloxyoxalyl derivatives of 2-arylpyrrole were synthesized, and their structures were characterized by 1H NMR spectroscopy, elemental analysis, and single-crystal X-ray diffraction analysis. The insecticidal activities of the new compounds were evaluated. The results of bioassays indicated that some of these title compounds exhibited excellent insecticidal activities, and their insecticidal activities against oriental armyworm, mosquito, and spider mite are comparable to those of the commercialized Chlorfenapyr.

First-in-class pan caspase inhibitor developed for the treatment of liver disease

Linton, Steven D.,Aja, Teresa,Armstrong, Robert A.,Bai, Xu,Chen, Long-Shiuh,Chen, Ning,Ching, Brett,Contreras, Patricia,Diaz, Jose-Luis,Fisher, Craig D.,Fritz, Lawrence C.,Gladstone, Patricia,Groessl, Todd,Gu, Xin,Herrmann, Julia,Hirakawa, Brad P.,Hoglen, Niel C.,Jahangiri, Kathy G.,Kalish, Vincent J.,Karanewsky, Donald S.,Kodandapani, Lalitha,Krebs, Joseph,McQuiston, Jeff,Meduna, Steven P.,Nalley, Kip,Robinson, Edward D.,Sayers, Robert O.,Sebring, Kristen,Spada, Alfred P.,Ternansky, Robert J.,Tomaselli, Kevin J.,Ullman, Brett R.,Valentino, Karen L.,Weeks, Suzanne,Winn, David,Wu, Joe C.,Yeo, Pauline,Zhang, Cheng-Zhi

, p. 6779 - 6782 (2007/10/03)

A series of oxamyl dipeptides were optimized for pan caspase inhibition, anti-apoptotic cellular activity and in vivo efficacy. This structure-activity relationship study focused on the P4 oxamides and warhead moieties. Primarily on the basis of in vitro data, inhibitors were selected for study in a murine model of α-Fas-induced liver injury. IDN-6556 (1) was further profiled in additional in vivo models and pharmacokinetic studies. This first-in-class caspase inhibitor is now the subject of two Phase II clinical trials, evaluating its safety and efficacy for use in liver disease.

Oxamyl dipeptide caspase inhibitors developed for the treatment of stroke

Linton, Steven D.,Aja, Teresa,Allegrini, Peter R.,Deckwerth, Thomas L.,Diaz, Jose-Luis,Hengerer, Bastian,Herrmann, Julia,Jahangiri, Kathy G.,Kallen, Joerg,Karanewsky, Donald S.,Meduna, Steven P.,Nalley, Kip,Robinson, Edward D.,Roggo, Silvio,Rovelli, Giorgio,Sauter, Andre,Sayers, Robert O.,Schmitz, Albert,Smidt, Robert,Ternansky, Robert J.,Tomaselli, Kevin J.,Ullman, Brett R.,Wiessner, Christoph,Wu, Joe C.

, p. 2685 - 2691 (2007/10/03)

Structural modifications were made to a previously described acyl dipeptide caspase inhibitor, leading to the oxamyl dipeptide series. Subsequent SAR studies directed toward the warhead, P2, and P4 regions of this novel peptidomimetic are described herein.

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