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5-(2-Furyl)isoxazole-3-carboxylic acid is a chemical compound that belongs to the isoxazole carboxylic acid family. It features a central isoxazole ring with a furan group at the 2-position and a carboxylic acid group at the 3-position. This unique structure and reactivity make it a promising candidate for pharmaceuticals and organic synthesis, as well as for the preparation of various derivatives and analogs for medicinal and agrochemical applications.

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  • 98434-06-1 Structure
  • Basic information

    1. Product Name: 5-(2-FURYL)ISOXAZOLE-3-CARBOXYLIC ACID
    2. Synonyms: 5-(2-furyl)-3-isoxazolecarboxylic acid;5-(2-furanyl)-3-isoxazolecarboxylic acid;TIMTEC-BB SBB007153;5-FURAN-2-YL-ISOXAZOLE-3-CARBOXYLIC ACID;AKOS B022856;AKOS PAO-1387;AKOS BBS-00006855;5-(2-FURYL)ISOXAZOLE-3-CARBOXYLIC ACID
    3. CAS NO:98434-06-1
    4. Molecular Formula: C8H5NO4
    5. Molecular Weight: 179.13
    6. EINECS: N/A
    7. Product Categories: Oxazole&Isoxazole
    8. Mol File: 98434-06-1.mol
  • Chemical Properties

    1. Melting Point: 151 °C
    2. Boiling Point: 418.4 °C at 760 mmHg
    3. Flash Point: 206.8 °C
    4. Appearance: /
    5. Density: 1.42 g/cm3
    6. Vapor Pressure: 9.5E-08mmHg at 25°C
    7. Refractive Index: 1.555
    8. Storage Temp.: Sealed in dry,Store in freezer, under -20°C
    9. Solubility: N/A
    10. PKA: 3.33±0.10(Predicted)
    11. CAS DataBase Reference: 5-(2-FURYL)ISOXAZOLE-3-CARBOXYLIC ACID(CAS DataBase Reference)
    12. NIST Chemistry Reference: 5-(2-FURYL)ISOXAZOLE-3-CARBOXYLIC ACID(98434-06-1)
    13. EPA Substance Registry System: 5-(2-FURYL)ISOXAZOLE-3-CARBOXYLIC ACID(98434-06-1)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: 36/37/38
    3. Safety Statements: 22-26-36/37/39
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: IRRITANT
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 98434-06-1(Hazardous Substances Data)

98434-06-1 Usage

Uses

Used in Pharmaceutical Industry:
5-(2-Furyl)isoxazole-3-carboxylic acid is used as a building block for the development of new pharmaceutical compounds. Its presence of the furan group and carboxylic acid functionality allows for further modification and diversification to generate new compounds with desired properties and activities, making it a valuable asset in drug discovery and design.
Used in Organic Synthesis:
In the field of organic synthesis, 5-(2-Furyl)isoxazole-3-carboxylic acid serves as a versatile intermediate for the synthesis of various organic compounds. Its unique structure and reactivity enable the formation of a wide range of derivatives, expanding the scope of chemical reactions and applications.
Used in Agrochemical Industry:
5-(2-Furyl)isoxazole-3-carboxylic acid is also utilized in the agrochemical industry for the preparation of various agrochemicals. Its potential as a building block for the development of new agrochemical compounds can contribute to the creation of more effective and environmentally friendly products.
Used in the Preparation of Derivatives and Analogs:
5-(2-Furyl)isoxazole-3-carboxylic acid is used as a starting material for the preparation of various derivatives and analogs. Its unique structure allows for the generation of new compounds with specific properties and activities, which can be applied in different fields, including pharmaceuticals, agrochemicals, and other industries.

Check Digit Verification of cas no

The CAS Registry Mumber 98434-06-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 9,8,4,3 and 4 respectively; the second part has 2 digits, 0 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 98434-06:
(7*9)+(6*8)+(5*4)+(4*3)+(3*4)+(2*0)+(1*6)=161
161 % 10 = 1
So 98434-06-1 is a valid CAS Registry Number.
InChI:InChI=1/C8H5NO4/c10-8(11)5-4-7(13-9-5)6-2-1-3-12-6/h1-4H,(H,10,11)

98434-06-1SDS

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 5-(Furan-2-yl)isoxazole-3-carboxylic acid

1.2 Other means of identification

Product number -
Other names 5-(furan-2-yl)-1,2-oxazole-3-carboxylic 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:98434-06-1 SDS

98434-06-1Downstream Products

98434-06-1Relevant articles and documents

ATF6 INHIBITORS AND USES THEREOF

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, (2019/10/29)

Compounds as inhibitors of Activating Transcription Factor 6 (ATF6) are provided. The compounds may find use as therapeutic agents for the treatment of diseases or disorders mediated by ATF6 and may find particular use in the treatment of viral infections, neurodegenerative diseases, vascular diseases, or cancer.

PHARMACEUTICAL COMPOSITION FOR PREVENTINTION AND TREATMENT OF RESTENOSIS COMPRISING ISOXAZOLE DERIVATIVES

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Page/Page column 18, (2009/03/07)

There is provided a pharmaceutical composition for prevention and treatment of restenosis comprising isoxazole derivatives. The pharmaceutical composition includes a therapeutic effective amount of isoxazole derivatives represented by Formula 1 or pharmaceutically available salts thereof. The pharmaceutical composition may be useful to prevent and treat vascular restenosis since the pharmaceutical composition shows an anti-restenosis activity and accelerates the re-endothelization.

ISOXAZOLE DERIVATIVES AND USE THEREOF

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Page/Page column 12, (2009/05/28)

Disclosed herein are isoxazole derivatives and uses thereof. Serving as agonists of Wnt, the isoxazole derivatives activate Wnt/beta-catenin signaling and thus can be used in the treatment and prevention of diseases related to the signal transduction. Also, pharmaceutically acceptable salts of the isoxazole derivatives are disclosed

ISOXAZOLE DERIVATIVES AND USE THEREOF

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Page/Page column 36, (2010/11/28)

Disclosed herein are isoxazole derivaties and uses thereof. Serving as agonists of Wnt, the isoxazole derivatives activate Wnt/β-catenin signaling and thus can be used in the treatment and prevention of diseases related to the signal transduction. Also, pharmaceutically acceptable salts of the isoxazole derivatives are disclosed.

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