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172649-57-9

5-chloromethyloxazole is a chemical compound with the molecular formula C4H4ClNO, belonging to the oxazole class of organic compounds. It features a chloride group and a methyl group attached to the oxazole ring, which endows it with a versatile chemical structure. This structure makes 5-chloromethyloxazole a valuable building block for the synthesis of a wide range of pharmaceuticals, agrochemicals, and other organic compounds. It also serves as a reagent in organic synthesis and a precursor for the preparation of oxazole-based compounds with potential biological activities. Furthermore, 5-chloromethyloxazole has been explored for its potential as an antibacterial and antifungal agent, although more research is required to fully understand its biological properties and applications.

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  • 172649-57-9 Structure

  • Basic information

    1. Product Name: 5-chloromethyloxazole
    2. Synonyms: OXAZOLE, 5-(CHLOROMETHYL)-;5-chloromethyloxazole;5-(CchloroMethyl)oxazole
    3. CAS NO:172649-57-9
    4. Molecular Formula: C4H4ClNO
    5. Molecular Weight: 117.53
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 172649-57-9.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.: under inert gas (nitrogen or Argon) at 2-8°C
    8. Solubility: N/A
    9. CAS DataBase Reference: 5-chloromethyloxazole(CAS DataBase Reference)
    10. NIST Chemistry Reference: 5-chloromethyloxazole(172649-57-9)
    11. EPA Substance Registry System: 5-chloromethyloxazole(172649-57-9)

  • 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: 172649-57-9(Hazardous Substances Data)

172649-57-9 Usage

Uses

Used in Pharmaceutical Synthesis:
5-chloromethyloxazole is used as a building block for the synthesis of various pharmaceuticals due to its versatile chemical structure, which allows for the creation of a broad spectrum of medicinal compounds.
Used in Agrochemical Synthesis:
In the agrochemical industry, 5-chloromethyloxazole is utilized as a building block for the development of new agrochemicals, contributing to the creation of effective products for agricultural applications.
Used as a Reagent in Organic Synthesis:
5-chloromethyloxazole serves as a reagent in organic synthesis, facilitating various chemical reactions and contributing to the formation of desired organic compounds.
Used in the Preparation of Oxazole-based Compounds:
It is used as a precursor for the preparation of oxazole-based compounds that possess potential biological activities, indicating its importance in the development of new biologically active molecules.
Used in Antibacterial and Antifungal Research:
5-chloromethyloxazole is used in research as a potential antibacterial and antifungal agent, highlighting its potential applications in the field of infectious disease treatment. Further research is necessary to confirm its effectiveness and range of action in this area.

Check Digit Verification of cas no

The CAS Registry Mumber 172649-57-9 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 1,7,2,6,4 and 9 respectively; the second part has 2 digits, 5 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 172649-57:
(8*1)+(7*7)+(6*2)+(5*6)+(4*4)+(3*9)+(2*5)+(1*7)=159
159 % 10 = 9
So 172649-57-9 is a valid CAS Registry Number.

172649-57-9SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name 5-(Chloromethyl)oxazole

1.2 Other means of identification

Product number -
Other names 5-(chloromethyl)-1,3-oxazole

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:172649-57-9 SDS

172649-57-9Upstream product

172649-57-9Downstream Products

172649-57-9Relevant articles and documents

Synthesis of Arylethylamines via C(sp3)-C(sp3) Palladium-Catalyzed Cross-Coupling

Lippa, Rhys A.,Battersby, David J.,Murphy, John A.,Barrett, Tim N.

, p. 3583 - 3604 (2021/02/27)

Substituted arylethylamines represent a key structural motif in natural, pharmaceutical, and agrochemical compounds. Access to such scaffolds has been the subject of long-standing synthetic interest. Herein, we report the synthesis of such scaffolds via a palladium-catalyzed C(sp3)-C(sp3) coupling between (chloromethyl)aryls and air-/moisture-stable N,N-dialkylaminomethyltrifluoroborate salts. Rapid hit identification was achieved using microscale high-throughput experimentation and was followed by millimolar-scale reaction parameter optimization. A range of structurally and electronically varied arylethylamine products were obtained in moderate to excellent yields (27-96%, >60 examples). The reaction mechanism is proposed to proceed via formation of a trialkylbenzylammonium species prior to oxidative addition.

HEPATITIS B CORE PROTEIN ALLOSTERIC MODULATORS

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Paragraph 000283, (2015/10/05)

ABSTRACT The present disclosure provides, in part, compounds having allosteric effector properties against Hepatitis B virus Cp. Also provided herein are methods of treating viral infections, such as hepatitis B, comprising administering to a patient in need thereof a disclosed compound.

ANTIPROLIFERATIVE BENZO [B] AZEPIN- 2 - ONES

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Page/Page column 44; 45, (2014/02/15)

Disclosed are compounds of Formula (I) or pharmaceutically acceptable salts thereof, wherein W, X, Y, Z, R1, R2, R3 and R4 are described in this application, and methods of using said compounds in the treatment of cancer.

Total synthesis of potent antifungal marine bisoxazole natural products bengazoles A and B

Bull, James A.,Balskus, Emily P.,Horan, Richard A.J.,Langner, Martin,Ley, Steven V.

, p. 5515 - 5538 (2008/02/10)

The bengazoles are a family of marine natural products that display potent antifungal activity and a unique structure, containing two oxazole rings flanking a single carbon atom. Total syntheses of bengazole A and B are described, which contain a sensitive stereogenic centre at this position between the two oxazolcs. Additionally, the synthesis of 10-epi-bengazole A is reported. Two parallel synthetic routes were investigated, relying on construction of the 2,4-disubstituted oxazole under mild conditions and a diastereoselective 1,3-dipolar cycloaddition. Our successful route is high yielding, provides rapid access to single stereoisomers of the complex natural products and allows the synthesis of analogues for biological evaluation.

RETROVIRAL PROTEASE INHIBITING PIPERAZINE COMPOUNDS

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, (2008/06/13)

Retroviral protease inhibiting compounds of the formula: STR1 are disclosed.

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