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651013-72-8

3-Benzyl-4-Methoxy-4-oxobutanoic acid, also known as BMBA, is a chemical compound with a molecular formula C12H14O4. It is a derivative of butanoic acid, featuring a benzyl group and a methoxy group. BMBA is recognized for its potential therapeutic properties, making it a valuable component in organic synthesis and pharmaceutical research. Its anti-inflammatory, antioxidant, and potential anticancer activities have garnered significant interest in the field of medicinal chemistry.

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  • 651013-72-8 Structure

  • Basic information

    1. Product Name: 3-Benzyl-4-Methoxy-4-oxobutanoic acid
    2. Synonyms: 3-Benzyl-4-Methoxy-4-oxobutanoic acid
    3. CAS NO:651013-72-8
    4. Molecular Formula: C12H14O4
    5. Molecular Weight: 222.23716
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 651013-72-8.mol

  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 364.7±30.0 °C(Predicted)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.189±0.06 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: Sealed in dry,Room Temperature
    8. Solubility: N/A
    9. PKA: 4.43±0.19(Predicted)
    10. CAS DataBase Reference: 3-Benzyl-4-Methoxy-4-oxobutanoic acid(CAS DataBase Reference)
    11. NIST Chemistry Reference: 3-Benzyl-4-Methoxy-4-oxobutanoic acid(651013-72-8)
    12. EPA Substance Registry System: 3-Benzyl-4-Methoxy-4-oxobutanoic acid(651013-72-8)

  • 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: 651013-72-8(Hazardous Substances Data)

651013-72-8 Usage

Uses

Used in Pharmaceutical Research:
3-Benzyl-4-Methoxy-4-oxobutanoic acid is used as a research compound for its potential therapeutic properties, including anti-inflammatory, antioxidant, and anticancer activities. Its ability to inhibit the production of prostaglandins and leukotrienes, which are involved in the body's inflammatory response, makes it a promising candidate for the development of new medications.
Used in Organic Synthesis:
In the field of organic synthesis, 3-Benzyl-4-Methoxy-4-oxobutanoic acid is used as a key intermediate for the synthesis of various pharmaceuticals and organic compounds. Its unique structure and functional groups allow for versatile chemical reactions, facilitating the creation of a wide range of molecules with potential applications in medicine and other industries.
Used in Anti-Inflammatory Applications:
3-Benzyl-4-Methoxy-4-oxobutanoic acid is used as an anti-inflammatory agent due to its inhibitory effects on the production of prostaglandins and leukotrienes. This makes it a valuable component in the development of treatments for various inflammatory conditions, potentially offering new therapeutic options for patients.
Used in Antioxidant Formulations:
Given its antioxidant properties, 3-Benzyl-4-Methoxy-4-oxobutanoic acid is used in the formulation of antioxidant supplements and products. Its ability to neutralize free radicals and protect cells from oxidative damage contributes to its potential use in health and wellness applications.
Used in Anticancer Research:
3-Benzyl-4-Methoxy-4-oxobutanoic acid is used as a potential anticancer agent in research studies. Its potential to target and inhibit cancer cell growth and proliferation makes it a subject of interest for the development of novel cancer therapies.

Check Digit Verification of cas no

The CAS Registry Mumber 651013-72-8 includes 9 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 6 digits, 6,5,1,0,1 and 3 respectively; the second part has 2 digits, 7 and 2 respectively.
Calculate Digit Verification of CAS Registry Number 651013-72:
(8*6)+(7*5)+(6*1)+(5*0)+(4*1)+(3*3)+(2*7)+(1*2)=118
118 % 10 = 8
So 651013-72-8 is a valid CAS Registry Number.

651013-72-8SDS

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-benzylsuccinic acid 1-methyl ester

1.2 Other means of identification

Product number -
Other names 2-benzyl-4-hydrogen-1-methylsuccinate

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:651013-72-8 SDS

651013-72-8Relevant articles and documents

Kinetic resolution of 3-hydroxymethylbenzocycloalkanols by selective asymmetric hydrogen-transfer oxidation

Caro, Yolanda,Torrado, Maria,Masaguer, Christian F.,Ravina, Enrique

, p. 3689 - 3696 (2007/10/03)

Kinetic resolution of 3-hydroxymethylbenzocycloalkanols was performed by selective asymmetric hydrogen-transfer oxidation using the Ru(II)-(S,S)-TsDPEN catalyst. Thus, several 3-hydroxymethyl-1-tetralols 7a-d afforded (1R,3R)-3-hydroxymethyl-1-tetralols (

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