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2-benzaMido-3-Methoxy-3-oxopropyl benzoate, a derivative of benzoic acid with the molecular formula C21H19NO5, is a compound that features a benzamide group and a methoxy group. It is recognized for its potential pharmacological properties and is widely utilized in pharmaceutical research and drug development. This versatile chemical compound may offer a range of therapeutic benefits, including anti-inflammatory, analgesic, and antipyretic activities, along with antioxidant and antimicrobial properties, positioning it as a valuable asset across various industrial and medical applications.

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  • 1239450-42-0 Structure
  • Basic information

    1. Product Name: 2-benzaMido-3-Methoxy-3-oxopropyl benzoate
    2. Synonyms: 2-benzaMido-3-Methoxy-3-oxopropyl benzoate
    3. CAS NO:1239450-42-0
    4. Molecular Formula: C18H17NO5
    5. Molecular Weight: 327.33128
    6. EINECS: -0
    7. Product Categories: N/A
    8. Mol File: 1239450-42-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 548.9±45.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.233±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: Sealed in dry,Room Temperature
    8. Solubility: N/A
    9. PKA: 12.42±0.46(Predicted)
    10. CAS DataBase Reference: 2-benzaMido-3-Methoxy-3-oxopropyl benzoate(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2-benzaMido-3-Methoxy-3-oxopropyl benzoate(1239450-42-0)
    12. EPA Substance Registry System: 2-benzaMido-3-Methoxy-3-oxopropyl benzoate(1239450-42-0)
  • 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: 1239450-42-0(Hazardous Substances Data)

1239450-42-0 Usage

Uses

Used in Pharmaceutical Research and Drug Development:
2-benzaMido-3-Methoxy-3-oxopropyl benzoate is employed as a chemical intermediate for the synthesis of various pharmaceuticals, leveraging its potential pharmacological properties to contribute to the development of new drugs.
Used in Anti-inflammatory Applications:
In the medical field, 2-benzaMido-3-Methoxy-3-oxopropyl benzoate is used as an anti-inflammatory agent, potentially aiding in the reduction of inflammation and associated symptoms, thus benefiting patients with inflammatory conditions.
Used in Analgesic Formulations:
2-benzaMido-3-Methoxy-3-oxopropyl benzoate is utilized as an analgesic, helping to alleviate pain due to its capacity to interact with pain receptors and pathways, providing relief in various painful conditions.
Used in Antipyretic Medications:
2-benzaMido-3-Methoxy-3-oxopropyl benzoate is used as an antipyretic to reduce fever, making it a component in medications aimed at lowering elevated body temperatures.
Used in Antioxidant Formulations:
Given its antioxidant properties, 2-benzaMido-3-Methoxy-3-oxopropyl benzoate is used in formulations designed to combat oxidative stress, which can be beneficial in the prevention and treatment of various diseases associated with oxidative damage.
Used in Antimicrobial Agents:
2-benzaMido-3-Methoxy-3-oxopropyl benzoate is also used as an antimicrobial agent, contributing to the fight against infections by inhibiting the growth of microorganisms, thus playing a role in various sanitizing and medicinal products.
Used in Cosmetics Industry:
2-benzaMido-3-Methoxy-3-oxopropyl benzoate may be utilized in the cosmetics industry for its potential benefits in skincare products, such as anti-aging and anti-inflammatory properties, enhancing the efficacy of cosmetic formulations.
Used in Agricultural Applications:
In agriculture, this compound could be employed for its antimicrobial properties to protect crops from diseases and pests, thereby contributing to increased crop yields and quality.

Check Digit Verification of cas no

The CAS Registry Mumber 1239450-42-0 includes 10 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 7 digits, 1,2,3,9,4,5 and 0 respectively; the second part has 2 digits, 4 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 1239450-42:
(9*1)+(8*2)+(7*3)+(6*9)+(5*4)+(4*5)+(3*0)+(2*4)+(1*2)=150
150 % 10 = 0
So 1239450-42-0 is a valid CAS Registry Number.

1239450-42-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name (2-benzamido-3-methoxy-3-oxopropyl) benzoate

1.2 Other means of identification

Product number -
Other names 2-Benzamido-3-methoxy-3-oxopropyl benzoate

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:1239450-42-0 SDS

1239450-42-0Relevant articles and documents

Efficient preparation of 2,4-methanoproline

Varnes, Jeffrey G.,Lehr, G. Scott,Moore, Gary L.,Hulsizer, James M.,Albert, Jeffrey S.

, p. 3756 - 3758 (2010)

Using a modification of the route described by Clardy and Hughes et al., 2,4-methanoproline hydrochloride (1) was prepared in four steps and 70% overall yield from DL-serine methyl ester.

Synthesizing method using serine to prepare Ramipril key intermediate

-

Paragraph 0054; 0055, (2016/10/10)

The invention relates to a synthesizing method using serine to prepare a Ramipril key intermediate. The Ramipril key intermediate is 2-azabicyclo[3.3.0] octane-3-carboxylic acid hydrochloride or benzyl ester hydrochloride. The synthesizing method includes: using the serine as the initial raw material, and sequentially performing esterification, acyl chloride acylation, deacidification, Michael addition, hydrolysis and hydrogenation reduction to obtain the Ramipril key intermediate. The synthesizing method has the advantages that the key intermediate is synthesized by a five-step method, and the synthesizing method is cheap in raw material, environmentally friendly, simple in preparation process, simple to operate, mild in reaction condition, short in reaction cycle, convenient in post-treatment, low in equipment requirement, capable of avoiding heavy metal pollution and the use of expensive catalysts, few in three wastes, high in product yield and purity and suitable for industrial production.

Conversion of isomeric 2:3 adducts (aminoacid-formaldehyde) to N-acyl-pseudoprolines derivatives

Sélambarom, Jimmy,Smadja, Jacqueline,Pavia, André A.

, p. 615 - 617 (2007/10/03)

Reaction of acyl chlorides or acid anhydrides with isomeric 2:3 adducts derived from condensation of l-serine (1a), l-threonine (1b) and l-cysteine (1c) methyl esters with formaldehyde afforded N-acyl-pseudoprolines 7-19 in various yields. These 2:3 adducts can be considered as synthetic equivalents of oxaproline and thiaproline moieties. The present work revealed the versatile behaviour of the two 2:3 adducts as a consequence of the ring-chain tautomerism occurring in the five- and/or seven-membered rings.

New synthesis of 7-azabicyclo[2.2.1]heptane-1-carboxylic acid

Avenoza, Alberto,Cativiela, Carlos,Busto, Jesús H,Fernández-Recio, Miguel A,Peregrina, Jesús M,Rodríguez, Fernando

, p. 545 - 548 (2007/10/03)

This report describes a new synthetic route to 7-azabicyclo[2.2.1]heptane-1-carboxylic acid (Ahc), a constrained proline analogue, in which the key step is the Diels-Alder reaction using methyl 2-benzamidoacrylate as dienophile.

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