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4-(OXAZOL-2-YL)BENZOIC ACID, with the molecular formula C11H7NO3, is an organic compound characterized by a benzene ring connected to a carboxylic acid group and an oxazole ring. This versatile chemical serves as a fundamental building block in the synthesis of pharmaceuticals and other organic compounds, and it also functions as a reagent in various chemical reactions. Its potential biological activity and utility in material development make it a promising candidate for research in medicinal chemistry and drug development.

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  • 597561-78-9 Structure
  • Basic information

    1. Product Name: 4-(OXAZOL-2-YL)BENZOIC ACID
    2. Synonyms: 4-(OXAZOL-2-YL)BENZOIC ACID
    3. CAS NO:597561-78-9
    4. Molecular Formula: C10H7NO3
    5. Molecular Weight: 189.17
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 597561-78-9.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 375.8±44.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.320±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C
    8. Solubility: N/A
    9. PKA: 3.87±0.10(Predicted)
    10. CAS DataBase Reference: 4-(OXAZOL-2-YL)BENZOIC ACID(CAS DataBase Reference)
    11. NIST Chemistry Reference: 4-(OXAZOL-2-YL)BENZOIC ACID(597561-78-9)
    12. EPA Substance Registry System: 4-(OXAZOL-2-YL)BENZOIC ACID(597561-78-9)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 597561-78-9(Hazardous Substances Data)

597561-78-9 Usage

Uses

Used in Pharmaceutical Synthesis:
4-(OXAZOL-2-YL)BENZOIC ACID is used as a key building block for the creation of pharmaceuticals, leveraging its structural properties to contribute to the development of new drugs.
Used in Organic Compounds Synthesis:
In the realm of organic chemistry, 4-(OXAZOL-2-YL)BENZOIC ACID is utilized as a component in the synthesis of a variety of organic compounds, enhancing the diversity and complexity of chemical libraries.
Used as a Reagent in Chemical Reactions:
4-(OXAZOL-2-YL)BENZOIC ACID is employed as a reagent, facilitating specific chemical transformations and reactions that are essential in the advancement of chemical research and development.
Used in Material Development:
4-(OXAZOL-2-YL)BENZOIC ACID is also used in the development of new materials, where its unique properties can contribute to the creation of innovative and improved materials for various applications.
Used in Medicinal Chemistry Research:
4-(OXAZOL-2-YL)BENZOIC ACID is used as a subject of study in medicinal chemistry, where its potential biological activity is explored for future applications in drug development.
Used in Drug Development:
With its potential biological activity, 4-(OXAZOL-2-YL)BENZOIC ACID is of interest for further investigation in drug development, where it may lead to the discovery of new therapeutic agents.

Check Digit Verification of cas no

The CAS Registry Mumber 597561-78-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 5,9,7,5,6 and 1 respectively; the second part has 2 digits, 7 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 597561-78:
(8*5)+(7*9)+(6*7)+(5*5)+(4*6)+(3*1)+(2*7)+(1*8)=219
219 % 10 = 9
So 597561-78-9 is a valid CAS Registry Number.

597561-78-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 4-(Oxazol-2-yl)benzoic acid

1.2 Other means of identification

Product number -
Other names 4-(1,3-oxazol-2-yl)benzoic acid

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:597561-78-9 SDS

597561-78-9Relevant articles and documents

Ring size changes in the development of class I HDAC inhibitors

Cho, Er-Chieh,Liu, Chi-Yuan,Tang, Di-Wei,Lee, Hsueh-Yun

, p. 1387 - 1401 (2021/07/06)

Five pathways involving different ring structures led to generation of fourteen thienylbenzamides (7–20) which display the structure-activity relationships of class I HDAC inhibitors. All the synthesised compounds inhibit HDAC1 and HDAC2 selectively over other isoforms and many inhibit DLD1 and HCT116 cells more effectively than a parent compound. Compounds 8 and 16 inhibit HCT116 cells by activation of the apoptosis pathway.

Synthesis method of 4-(oxazol-2-yl)benzoic acid

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, (2019/11/14)

The invention relates to a synthesis method of 4-(oxazol-2-yl)benzoic acid. Ethanolamine and 4-carboxybenzaldehyde are used as starting materials, firstly 4-(4,5-dihydroxazol-2-yl)benzoic acid is synthesized, then N-bromosuccinimide and azodiisobutyronitr

DOPAMINE D3 RECEPTOR ANTAGONISTS HAVING A MORPHOLINE MOIETY

-

Paragraph 0229, (2018/11/21)

The disclosure provides compounds of formula (I) or pharmaceutically acceptable salts thereof: The disclosure also provides processes for their preparation, intermediates used in these processes, pharmaceutical compositions containing them, and their use

DOPAMINE D3 RECEPTOR ANTAGONISTS COMPOUNDS

-

Page/Page column 112, (2016/05/19)

The disclosure is directed to novel dopamine D3 receptor antagonists, processes for their preparation, intermediates used in these processes, pharmaceutical compositions containing them and their use in therapy, including treating drug dependency and psychosis.

HETEROCYCLIC COMPOUNDS FOR THE INHIBITION OF PASK

-

, (2012/11/08)

Disclosed herein are new heterocyclic compounds and compositions and their application as pharmaceuticals for the treatment of disease. Methods of inhibiting PAS Kinase (PASK) activity in a human or animal subject are also provided for the treatment of diseases such as diabetes mellitus.

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