924869-17-0

Basic information

• Product Name: METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE
• Synonyms: METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE;Methyl benzo[d]oxazole-5-carboxylate;5-(Methoxycarbonyl)-1,3-benzoxazole, 5-(Methoxycarbonyl)benzo[d]oxazole;Methyl 5-Benzoxazolecarboxylate;5-(Methoxycarbonyl)benzoxazole;5-Benzoxazolecarboxylic acid methyl ester;Methyl benzoxazole-5-carboxylate
• CAS NO: 924869-17-0
• Molecular Formula: C₉H₇NO₃
• Molecular Weight: 177.15678
• Mol File: 924869-17-0.mol

Chemical Properties

• Melting Point: 110-111
• Appearance: /
• Storage Temp.: 2-8°C
• CAS DataBase Reference: METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE(CAS DataBase Reference)
• NIST Chemistry Reference: METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE(924869-17-0)
• EPA Substance Registry System: METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE(924869-17-0)

Safety Data

• Hazard Codes: Xi
• HazardClass: IRRITANT
• Hazardous Substances Data: 924869-17-0(Hazardous Substances Data)

Usage

Uses

Used in Pharmaceutical Industry:
METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE is used as a key intermediate for the synthesis of various pharmaceuticals, contributing to the development of new drugs and therapeutic agents. Its presence in the molecular structure of these compounds can enhance their pharmacological properties and efficacy.
Used in Agrochemical Industry:
In the agrochemical sector, METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE is utilized as a building block for the synthesis of agrochemicals, such as pesticides and herbicides. Its incorporation can improve the effectiveness of these chemicals in protecting crops and controlling pests.
Used in Organic Synthesis:
METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE is employed as a versatile reagent in organic synthesis, enabling the creation of a wide range of organic compounds with diverse applications in various industries.
Used in Drug Discovery:
Due to its potential biological and pharmacological properties, METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE is used in drug discovery processes. Its antimicrobial and antitumor activities make it a promising candidate for the development of new treatments for infectious diseases and cancer.
Used in Antimicrobial Applications:
METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE is used as an antimicrobial agent, exhibiting activity against various microorganisms. This property can be harnessed in the development of new antibiotics and antifungal agents.
Used in Antitumor Applications:
METHYL 1,3-BENZOXAZOLE-5-CARBOXYLATE is utilized in antitumor research, where it has shown potential in inhibiting the growth and progression of tumors. Its incorporation into drug development pipelines may lead to the discovery of novel anticancer drugs.

Upstream product

• 64-18-6 formic acid 
• 536-25-4 methyl 3-amino-4-hydroxybenzoate 
• 99-42-3 methyl (4-hydroxy-3-nitro)benzoate 
• 616-82-0 3-nitro-4-hydroxybenzoic acid 
• 149-73-5 trimethyl orthoformate 
• 67-56-1 methanol 
• 1571-72-8 3-amino-4-hydroxybenzoic acid 
• 122-51-0 orthoformic acid triethyl ester 

Downstream Products

• 1048974-16-8 C₁₅H₁₂N₂O₂ 
• 1048974-22-6 C₁₄H₉ClN₂O₂ 
• 1048974-19-1 C₁₅H₁₂N₂O₃ 
• 1048974-25-9 C₁₄H₉N₃O₄ 
• 1048974-14-6 C₁₄H₁₀N₂O₂ 
• 21095-63-6 2-phenyl-benzoxazole-5-carboxylic acid methyl ester 

Relevant articles and documents

Synthesis, Structure Revision, and Cytotoxicity of Nocarbenzoxazole G

The total synthesis of nocarbenzoxazoles F (1) and G (2), originally obtained from the marine-derived halophilic bacterial strain Nocardiopsis lucentensis DSM 44048, was achieved via a simple and versatile route involving microwave-assisted construction of a benzoxazole skeleton, followed by carbon-carbon bond formation with the corresponding aryl bromides. Unfortunately, the 1H and 13C NMR spectra of natural nocarbenzoxazole G did not agree with those of the synthesized compound. In particular, the spectra of the isolated and synthesized compounds showed considerable differences in the signals from the protons and carbons in the aryl group. The revised structure was validated by the total synthesis of the actual nocarbenzoxazole G (8c) molecule, which is a regioisomer of the compound that was reported earlier as nocarbenzoxazole G. The synthesized derivatives showed specific cytotoxicity to the human cervical carcinoma cell line, HeLa, but did not have any remarkable effect on the other cell lines.

Novel nocarbenzoxazole derivatives, a preparation method thereof and use thereof

The present invention relates to a novel nocarbenzoxazole derivative which can be useful for preventing or treating cancer diseases, a method for producing the same, and a pharmaceutical composition including the same as an active ingredient. More specifically, the present invention relates to a pharmaceutical composition for preventing or treating cancer diseases, wherein the pharmaceutical composition includes a compound represented by chemical formula 1 or a pharmaceutically acceptable salt thereof as an active ingredient.COPYRIGHT KIPO 2017

Carbon dioxide as the C1 source for direct C-H functionalization of aromatic heterocycles

(Equation Presented). A simple and straightforward method has been developed for the direct carboxylation of aromatic heterocylces such as oxazoles, thiazoles, and oxadiazoles using CO2 as the C1 source. The reactions require no metal catalyst and only Cs2CO3 as the base. A good functional group tolerance is achieved.

Synthesis of some novel 2-substituted-N-aryl-benzoxazole-5-carboxamides using cobalt dipyridine dichloride as a catalyst

(Chemical Equation Presented) An efficient synthesis of some novel 2-substituted-N-aryl-benzoxazole-5-carboxamides from 2-substituted - 5-carbomethoxy benzoxazole on treatment with different substituted anilines promoted by cobalt dipyridine dichloride as a catalyst is described. This new approach has the advantage of excellent yields (90%) and short reaction times 1-2 h.