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1004-96-2

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1004-96-2 Usage

Synthesis Reference(s)

Synthesis, p. 837, 1977 DOI: 10.1055/s-1977-24593

Check Digit Verification of cas no

The CAS Registry Mumber 1004-96-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 1,0,0 and 4 respectively; the second part has 2 digits, 9 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 1004-96:
(6*1)+(5*0)+(4*0)+(3*4)+(2*9)+(1*6)=42
42 % 10 = 2
So 1004-96-2 is a valid CAS Registry Number.
InChI:InChI=1/C6H7NO3/c1-4-3-5(10-7-4)6(8)9-2/h3H,1-2H3

1004-96-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name Methyl 3-methylisoxazole-5-carboxylate

1.2 Other means of identification

Product number -
Other names Methyl 3-methyl-1,2-oxazole-5-carboxylate

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:1004-96-2 SDS

1004-96-2Relevant articles and documents

Substituent effects in isoxazoles: Identification of 4-substituted isoxazoles as Michael acceptors

Lee, Connie K.Y.,Easton, Christopher J.,Gebara-Coghlan, Mariana,Radom, Leo,Scott, Anthony P.,Simpson, Gregory W.,Willis, Anthony C.

, p. 2031 - 2038 (2002)

Crystallographic and theoretical studies have been used to investigate substituent effects, which are manifest in electrochemical and yeast-catalysed reactions of 4- and 5-acyl-, alkoxycarbonyl-, cyano- and phenyl-substituted isoxazoles. The results show that isoxazoles substituted at the 4-position with π-electron-withdrawing substituents have enhanced C4-C5 bond polarity and are structurally similar to Michael acceptors. As a consequence there is elongation and weakening of their N-O bonds. By contrast, their 5-substituted regioisomers and isoxazoles substituted at C4 with conjugating, but not π-electron-withdrawing, substituents have diminished C4-C5 bond polarity. This results in the selective electrochemical and yeast-catalysed reduction of 4-substituted isoxazoles, as well as their hydrogenolytic ring cleavage and conjugate reduction with sodium borohydride.

HETEROARYL-SUBSTITUTED TRIAZOLES AS APJ RECEPTOR AGONISTS

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Paragraph 0671-0672; 0673, (2018/06/12)

Compounds of Formula (I) and Formula (II), pharmaceutically acceptable salt thereof, stereoisomers of any of the foregoing, or mixtures thereof are agonists of the APJ Receptor and may have use in treating cardiovascular and other conditions. Compounds of Formula I and Formula II have the following structures: where the definitions of the variables are provided herein.

HETEROCYCLIC NUCLEAR HORMONE RECEPTOR MODULATORS

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Paragraph 0700, (2014/07/08)

The invention provides a compound of Formula (I) pharmaceutically acceptable salts, pro-drugs, biologically active metabolites, stereoisomers and isomers thereof wherein the variable are defined herein. The compounds of the invention are useful for treating immunological and oncological conditions.

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