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42590-00-1

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42590-00-1 Usage

General Description

Methyl 4-hydroxy-3-methoxy-5-nitrobenzenecarboxylate is a chemical compound with the molecular formula C10H9NO6. It is known for its yellow crystalline appearance and is commonly used in the pharmaceutical industry for the synthesis of various medications. Methyl 4-hydroxy-3-methoxy-5-nitrobenzenecarboxylate is also used as an intermediate in the production of certain dyes and pigments. Methyl 4-hydroxy-3-methoxy-5-nitrobenzenecarboxylate is considered to be a potentially hazardous chemical and should be handled with care.

Check Digit Verification of cas no

The CAS Registry Mumber 42590-00-1 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 4,2,5,9 and 0 respectively; the second part has 2 digits, 0 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 42590-00:
(7*4)+(6*2)+(5*5)+(4*9)+(3*0)+(2*0)+(1*0)=101
101 % 10 = 1
So 42590-00-1 is a valid CAS Registry Number.
InChI:InChI=1/C9H9NO6/c1-15-7-4-5(9(12)16-2)3-6(8(7)11)10(13)14/h3-4,11H,1-2H3

42590-00-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 15, 2017

Revision Date: Aug 15, 2017

1.Identification

1.1 GHS Product identifier

Product name Methyl 4-hydroxy-3-methoxy-5-nitrobenzenecarboxylate

1.2 Other means of identification

Product number -
Other names methyl 4-hydroxy-3-methoxy-5-nitrobenzoate

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:42590-00-1 SDS

42590-00-1Relevant articles and documents

Design, Synthesis, and Pharmacological Characterization of a Neutral, Non-Prodrug Thrombin Inhibitor with Good Oral Pharmacokinetics

Hillisch, Alexander,Gericke, Kersten M.,Allerheiligen, Swen,Roehrig, Susanne,Schaefer, Martina,Tersteegen, Adrian,Schulz, Simone,Lienau, Philip,Gnoth, Mark,Puetter, Vera,Hillig, Roman C.,Heitmeier, Stefan

, p. 12574 - 12594 (2020/11/13)

Despite extensive research on small molecule thrombin inhibitors for oral application in the past decades, only a single double prodrug with very modest oral bioavailability has reached human therapy as a marketed drug. We have undertaken major efforts to identify neutral, non-prodrug inhibitors. Using a holistic analysis of all available internal data, we were able to build computational models and apply these for the selection of a lead series with the highest possibility of achieving oral bioavailability. In our design, we relied on protein structure knowledge to address potency and identified a small window of favorable physicochemical properties to balance absorption and metabolic stability. Protein structure information on the pregnane X receptor helped in overcoming a persistent cytochrome P450 3A4 induction problem. The selected compound series was optimized to a highly potent, neutral, non-prodrug thrombin inhibitor by designing, synthesizing, and testing derivatives. The resulting optimized compound, BAY1217224, has reached first clinical trials, which have confirmed the desired pharmacokinetic properties.

Benzimidazolecarboxylic acid fragment in GSK484 and preparation method of benzimidazolecarboxylic acid fragment

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Paragraph 0028; 0035; 0036, (2019/08/20)

The invention discloses a preparation method of a benzimidazolecarboxylic acid fragment in GSK484, and belongs to the field of chemical and pharmaceutical intermediates, wherein the benzimidazolecarboxylic acid fragment has a chemical name of 1-methyl-2-(

NEW HETEROCYCLIC COMPOUNDS

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Page/Page column 67; 115-116, (2019/06/17)

The invention provides new heterocyclic compounds having the general formula (IA) wherein A, L, X, Y, m, n, R1 and R2 are as described herein, compositions including the compounds, processes of manufacturing the compounds and methods of using the compounds.

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