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3,5-Dimethyl-4-isoxazolecarbonitrile, a white solid with the molecular formula C6H6N2O, is an isoxazole derivative characterized by a five-membered heterocyclic ring containing one nitrogen and one oxygen atom. It is a versatile chemical compound with applications in various industries.

31301-46-9

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31301-46-9 Usage

Uses

Used in Pharmaceutical Industry:
3,5-Dimethyl-4-isoxazolecarbonitrile is used as a building block for the synthesis of various drugs and pharmaceuticals. Its unique structure and properties make it a valuable component in the development of new medications.
Used in Agriculture:
3,5-Dimethyl-4-isoxazolecarbonitrile is used as a potential herbicide and insecticide. Its ability to control the growth of unwanted plants and insects makes it a valuable tool in agricultural applications.
Used in Antimicrobial and Antifungal Applications:
3,5-Dimethyl-4-isoxazolecarbonitrile exhibits antimicrobial and antifungal properties, making it useful in various industrial applications where controlling the growth of microorganisms is essential. Its broad-spectrum activity against different types of microbes contributes to its versatility in this area.

Check Digit Verification of cas no

The CAS Registry Mumber 31301-46-9 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,1,3,0 and 1 respectively; the second part has 2 digits, 4 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 31301-46:
(7*3)+(6*1)+(5*3)+(4*0)+(3*1)+(2*4)+(1*6)=59
59 % 10 = 9
So 31301-46-9 is a valid CAS Registry Number.
InChI:InChI=1/C6H6N2O/c1-4-6(3-7)5(2)9-8-4/h1-2H3

31301-46-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name 3,5-dimethyl-1,2-oxazole-4-carbonitrile

1.2 Other means of identification

Product number -
Other names 4-cyano-3,5-dimethylisoxazoline

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:31301-46-9 SDS

31301-46-9Relevant academic research and scientific papers

Ring Cleavage Reactions of 3- and 5-Non-substituted Isoxazoles

Alberola, A.,Gonzalez, A. M.,Guerra, D.,Pulido, F. J.

, p. 1073 - 1076 (2007/10/02)

5-Methylisoxazoles with electron-accepting groups at C-4 (Ia-c) and 2,3-dimethylisoxazolium iodide (II) undergo ring cleavage when treated with organic bases.The nature of the open chain products which were obtained (stable enolates, β-diketones, esters) depends on the group at C-4 and the strength of the base.In some of these processes aromatic aldehydes were used in order to determine the competition between the condensation and the cleavage reaction.The mechanism of the nucleophilic ring cleavage of II is also shown.

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