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745079-24-7

3-Isoxazolecarboxylic acid, 4-(hydroxymethyl)-5-(3-iodophenyl)-, ethyl ester (9CI) is a complex organic compound with the chemical formula C12H10INO3. It is a derivative of isoxazole, a heterocyclic compound consisting of a five-membered ring with one oxygen and two nitrogen atoms. The molecule features a 3-iodophenyl group attached to the isoxazole ring, which contributes to its unique chemical properties. The hydroxymethyl group is attached to the 4-position of the isoxazole ring, and the ethyl ester group is present at the 3-position, further modifying the molecule's reactivity and solubility. 3-Isoxazolecarboxylicacid,4-(hydroxymethyl)-5-(3-iodophenyl)-,ethylester(9CI) has potential applications in pharmaceuticals and chemical research due to its structural diversity and the presence of functional groups that can participate in various chemical reactions.

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  • 3-Isoxazolecarboxylicacid,4-(hydroxymethyl)-5-(3-iodophenyl)-,ethylester(9CI)

    Cas No: 745079-24-7

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  • 745079-24-7 Structure

  • Basic information

    1. Product Name: 3-Isoxazolecarboxylicacid,4-(hydroxymethyl)-5-(3-iodophenyl)-,ethylester(9CI)
    2. Synonyms: 3-Isoxazolecarboxylicacid,4-(hydroxymethyl)-5-(3-iodophenyl)-,ethylester(9CI)
    3. CAS NO:745079-24-7
    4. Molecular Formula: C13H12INO4
    5. Molecular Weight: 373.14
    6. EINECS: N/A
    7. Product Categories: ISOXAZOLE
    8. Mol File: 745079-24-7.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 3-Isoxazolecarboxylicacid,4-(hydroxymethyl)-5-(3-iodophenyl)-,ethylester(9CI)(CAS DataBase Reference)
    10. NIST Chemistry Reference: 3-Isoxazolecarboxylicacid,4-(hydroxymethyl)-5-(3-iodophenyl)-,ethylester(9CI)(745079-24-7)
    11. EPA Substance Registry System: 3-Isoxazolecarboxylicacid,4-(hydroxymethyl)-5-(3-iodophenyl)-,ethylester(9CI)(745079-24-7)

  • 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: 745079-24-7(Hazardous Substances Data)

745079-24-7 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 745079-24-7 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 7,4,5,0,7 and 9 respectively; the second part has 2 digits, 2 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 745079-24:
(8*7)+(7*4)+(6*5)+(5*0)+(4*7)+(3*9)+(2*2)+(1*4)=177
177 % 10 = 7
So 745079-24-7 is a valid CAS Registry Number.

745079-24-7SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name ethyl 4-(hydroxymethyl)-5-(3-iodophenyl)isoxazole-3-carboxylate

1.2 Other means of identification

Product number -
Other names 4-Hydroxymethyl-5-(3-iodo-phenyl)-isoxazole-3-carboxylic acid ethyl ester

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:745079-24-7 SDS

745079-24-7Relevant articles and documents

Protein-tyrosine phosphatase inhibitors and uses thereof

-

Page 27, (2010/02/09)

The present invention is directed to compounds of formula (I), or a pharmaceutically suitable salt or prodrug thereof, which are useful for the selective inhibition of protein tyrosine phosphatase-1B (PTP1B), and are useful for the treatment of disorders caused by overexpressed or altered protein tyrosine phosphatase 1B.

Isoxazole carboxylic acids as protein tyrosine phosphatase 1B (PTP1B) inhibitors

Zhao, Hongyu,Liu, Gang,Xin, Zhili,Serby, Michael D.,Pei, Zhonghua,Szczepankiewicz, Bruce G.,Hajduk, Philip J.,Abad-Zapatero, Cele,Hutchins, Charles W.,Lubben, Thomas H.,Ballaron, Stephen J.,Haasch, Deanna L.,Kaszubska, Wiweka,Rondinone, Cristina M.,Trevillyan, James M.,Jirousek, Michael R.

, p. 5543 - 5546 (2007/10/03)

Guided by X-ray crystallography, we have extended the structure-activity relationship (SAR) study on an isoxazole carboxylic acid-based PTP1B inhibitor (1) and more potent and equally selective (>20-fold selectivity over the highly homologous T-cell PTPase, TCPTP) PTP1B inhibitors were identified. Inhibitor 7 demonstrated good cellular activity against PTP1B in COS 7 cells. Guided by X-ray crystallography, we have extended the structure-activity relationship (SAR) study on an isoxazole carboxylic acid-based PTP1B inhibitor (1) and more potent and equally selective (>20-fold selectivity over the highly homologous T-cell PTPase, TCPTP) PTP1B inhibitors were identified. Inhibitor 7 demonstrated good cellular activity against PTP1B in COS 7 cells.

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