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53638-98-5

1,4-Phthalazinedione, 2,3-dihydro-2-(4-methoxyphenyl)-, also known as N-(4-Methoxyphenyl)-2,3-dihydro-1,4-phthalazinedione, is a chemical compound with the molecular formula C15H13NO3. It is a derivative of phthalazinedione, featuring a 4-methoxyphenyl group attached to the nitrogen atom. 1,4-Phthalazinedione, 2,3-dihydro-2-(4-methoxyphenyl)- is often used as an intermediate in the synthesis of various pharmaceuticals and agrochemicals, particularly in the production of herbicides and other chemical products. Its structure provides a stable platform for further chemical modifications, making it a valuable component in the development of new compounds with specific properties and applications.

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  • 53638-98-5 Structure

  • Basic information

    1. Product Name: 1,4-Phthalazinedione, 2,3-dihydro-2-(4-methoxyphenyl)-
    2. Synonyms:
    3. CAS NO:53638-98-5
    4. Molecular Formula: C15H12N2O3
    5. Molecular Weight: 268.272
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 53638-98-5.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: N/A
    3. Flash Point: N/A
    4. Appearance: N/A
    5. Density: N/A
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: 1,4-Phthalazinedione, 2,3-dihydro-2-(4-methoxyphenyl)-(CAS DataBase Reference)
    10. NIST Chemistry Reference: 1,4-Phthalazinedione, 2,3-dihydro-2-(4-methoxyphenyl)-(53638-98-5)
    11. EPA Substance Registry System: 1,4-Phthalazinedione, 2,3-dihydro-2-(4-methoxyphenyl)-(53638-98-5)

  • 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: 53638-98-5(Hazardous Substances Data)

53638-98-5 Usage

Explanation

The molecular formula represents the number of atoms of each element present in a molecule of the compound.

Explanation

A derivative is a compound that is structurally related to another compound, in this case, phthalazine.

Explanation

The 4-methoxyphenyl group is a functional group attached to the phthalazine core, which contributes to the compound's properties and reactivity.

Explanation

The compound is a solid at room temperature, and it has a yellow color.

Explanation

The compound is used in the production of dyes and pigments due to its chemical properties and color.

Explanation

The compound is used in the synthesis of pharmaceuticals, as it can be a building block or a precursor for various drug molecules.

Explanation

The compound can be used as a starting material or intermediate in the synthesis of other organic compounds due to its unique structure and properties.

Explanation

The compound's unique properties and structure make it a candidate for further research and development in various industrial applications.

Explanation

The chemical structure describes the arrangement of atoms and bonds in the molecule, which determines its properties and reactivity.

Derivative of phthalazine

Yes

Contains a 4-methoxyphenyl group

Yes

Physical state

Yellow solid

Application in dyes and pigments

Yes

Application in pharmaceutical synthesis

Yes

Application in organic synthesis

Yes

Potential research and industrial applications

Yes

Chemical structure

1,4-Phthalazinedione, 2,3-dihydro-2-(4-methoxyphenyl)-

Check Digit Verification of cas no

The CAS Registry Mumber 53638-98-5 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 5,3,6,3 and 8 respectively; the second part has 2 digits, 9 and 8 respectively.
Calculate Digit Verification of CAS Registry Number 53638-98:
(7*5)+(6*3)+(5*6)+(4*3)+(3*8)+(2*9)+(1*8)=145
145 % 10 = 5
So 53638-98-5 is a valid CAS Registry Number.

53638-98-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(4-methoxy-phenyl)-2,3-dihydro-phthalazine-1,4-dione

1.2 Other means of identification

Product number -
Other names 2-(4-Methoxyphenyl)-phthalazin-1,4-dion

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:53638-98-5 SDS

53638-98-5Relevant articles and documents

Ru(II)-Catalyzed C-H Activation and Annulation Reaction via Carbon-Carbon Triple Bond Cleavage

Prakash, Rashmi,Bora, Bidisha R.,Boruah, Romesh C.,Gogoi, Sanjib

supporting information, p. 2297 - 2300 (2018/04/30)

An unprecedented Ru(II)-catalyzed C-H activation and annulation reaction, which proceeds via C-C triple bond cleavage, is reported. This reaction of 2-phenyldihydrophthalazinediones with alkynes, which works most efficiently in the presence of bidented ligand 1,3-bis(diphenylphosphino)propane, affords good yields of substituted quinazolines.

Phthalazinone pyrazoles as potent, selective, and orally bioavailable inhibitors of Aurora-A kinase

Prime, Michael E.,Courtney, Stephen M.,Brookfield, Frederick A.,Marston, Richard W.,Walker, Victoria,Warne, Justin,Boyd, Andrew E.,Kairies, Norman A.,Von Der Saal, Wolfgang,Limberg, Anja,Georges, Guy,Engh, Richard A.,Goller, Bernhard,Rueger, Petra,Rueth, Matthias

experimental part, p. 312 - 319 (2011/03/20)

The inhibition of Aurora kinases in order to arrest mitosis and subsequently inhibit tumor growth via apoptosis of proliferating cells has generated significant discussion within the literature. We report a novel class of Aurora kinase inhibitors based upon a phthalazinone pyrazole scaffold. The development of the phthalazinone template resulted in a potent Aurora-A selective series of compounds (typically >1000-fold selectivity over Aurora-B) that display good pharmacological profiles with significantly improved oral bioavailability compared to the well studied Aurora inhibitor VX-680.

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