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5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone is a chemical compound characterized by the presence of an iodine atom at the 5-position, a phenylmethyl group at the 2-position, and a pyridazinone ring structure. It is a versatile intermediate in organic synthesis and has potential applications in various fields.

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  • 825633-93-0 Structure
  • Basic information

    1. Product Name: 5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone
    2. Synonyms: 2-Benzyl-5-iodopyridazin-3(2H)-one;5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone;2-benzyl-5-iodopyridazin-3-one;2-Benzyl-5-iodopyridazin-3(2H)
    3. CAS NO:825633-93-0
    4. Molecular Formula: C11H9IN2O
    5. Molecular Weight: 312
    6. EINECS: -0
    7. Product Categories: N/A
    8. Mol File: 825633-93-0.mol
  • Chemical Properties

    1. Melting Point: 136-137℃
    2. Boiling Point: 370℃
    3. Flash Point: 178℃
    4. Appearance: /
    5. Density: 1.70
    6. Refractive Index: N/A
    7. Storage Temp.: 2-8°C
    8. Solubility: N/A
    9. CAS DataBase Reference: 5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone(CAS DataBase Reference)
    10. NIST Chemistry Reference: 5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone(825633-93-0)
    11. EPA Substance Registry System: 5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone(825633-93-0)
  • 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: 825633-93-0(Hazardous Substances Data)

825633-93-0 Usage

Uses

Used in Pharmaceutical Industry:
5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone is used as a reactant in high-temperature palladium (Pd)-catalyzed intramolecular direct arylations. This reaction is crucial for the synthesis of complex organic molecules, including pharmaceutical compounds, where the formation of carbon-carbon bonds is essential.
Used in Organic Synthesis:
5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone serves as a valuable building block in organic synthesis, enabling the construction of diverse molecular structures. Its unique functional groups and structural features make it suitable for various synthetic transformations, leading to the development of new compounds with potential applications in various industries.
Used in Chemical Research:
As a novel and interesting chemical entity, 5-Iodo-2-(phenylmethyl)-3(2H)-pyridazinone is employed in chemical research to explore new reaction pathways, investigate the reactivity of functional groups, and understand the underlying mechanisms of various chemical processes. This research can contribute to the advancement of synthetic methodologies and the discovery of new compounds with potential applications.

Check Digit Verification of cas no

The CAS Registry Mumber 825633-93-0 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 8,2,5,6,3 and 3 respectively; the second part has 2 digits, 9 and 3 respectively.
Calculate Digit Verification of CAS Registry Number 825633-93:
(8*8)+(7*2)+(6*5)+(5*6)+(4*3)+(3*3)+(2*9)+(1*3)=180
180 % 10 = 0
So 825633-93-0 is a valid CAS Registry Number.

825633-93-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 11, 2017

Revision Date: Aug 11, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-benzyl-5-iodopyridazin-3-one

1.2 Other means of identification

Product number -
Other names 2-benzyl-5-iodopyridazin-3(2H)-one

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:825633-93-0 SDS

825633-93-0Relevant articles and documents

NOVEL NITROGEN-CONTAINING AROMATIC HETEROCYCLIC COMPOUND

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Paragraph 0135, (2018/10/15)

A compound represented by general formula [1] wherein X represents N or the like, Y represents CH or the like; RA represents a cycloalkyl group which may be substituted or the like, R1 represents an alkyl group or the like, R2 represents an alkyl group which may be substituted or the like, R3 represents a hydrogen atom or an alkyl group, or a pharmaceutically acceptable salt thereof has an inhibitory activity on aldosterone synthetase, and is useful as a prophylactic and/or therapeutic agent for various diseases or symptoms associated with aldosterone.

PYRIDAZINONE DERIVATIVES AS PHOSHOINOSITIDE 3-KINASES INHIBITORS

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Paragraph 0174; 0175, (2016/04/09)

Compounds of formula (I) described herein inhibit phosphoinositide 3-kinases (PI3K) and useful for the treatment of disorders associated with PI3K enzymes.

SERINE/THREONINE KINASE INHIBITORS

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Paragraph 00212, (2015/07/16)

Compounds of Formula I or a stereoisomer, tautomer or pharmaceutically acceptable salt thereof are provided, which are useful for the treatment of diseases. Methods of using compounds of Formula I or a stereoisomer, tautomer or pharmaceutically acceptable salt thereof, for in vitro, in situ, and in vivo diagnosis, prevention or treatment of such diseases, or associated pathological conditions are disclosed.

IMIDAZO[1,2-a]PYRIDINES AND IMIDAZO[1,2-b]PYRIDAZINES AS MARK INHIBITORS

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Page/Page column 25-26, (2010/08/08)

The invention encompasses imidazo[1,2-a]pyridine and imidazo[1,2-b]pyridazine derivatives which selectively inhibit microtubule affinity regulating kinase (MARK) and are therefore useful for the treatment or prevention of Alzheimer's disease. Pharmaceutical compositions and methods of use are also included.

Pyridazine derivatives. Part 39: Reactivity of 5-iodopyridazin-3(2H)-ones in palladium-catalysed reactions

Coelho, Alberto,Sotelo, Eddy,Novoa, Héctor,Peeters, Oswald M.,Blaton, Norbert,Ravi?a, Enrique

, p. 12177 - 12189 (2007/10/03)

In the search for novel antiplatelet agents, convenient and efficient methods for the preparation of 2,5-disubstituted pyridazin-3(2H)-ones are reported that utilise palladium-catalysed cross-coupling reactions. A post-coupling base-promoted isomerisation

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