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(E)-oct-2-enedioic acid, also known as (E)-oct-2-enedioate or fumaric acid, is a dicarboxylic acid with the molecular formula C6H4(CO2H)2. It is naturally found in various plants and fruits and is characterized by its tart taste. Fumaric acid is a versatile compound with applications in the food industry, pharmaceuticals, polymer production, and as a precursor in the synthesis of various organic compounds.

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  • 5698-50-0 Structure
  • Basic information

    1. Product Name: (E)-oct-2-enedioic acid
    2. Synonyms: (E)-oct-2-enedioic acid
    3. CAS NO:5698-50-0
    4. Molecular Formula: C8H12O4
    5. Molecular Weight: 172.17848
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 5698-50-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 386.8 °C at 760 mmHg
    3. Flash Point: 201.9 °C
    4. Appearance: /
    5. Density: 1.2 g/cm3
    6. Vapor Pressure: 4.68E-07mmHg at 25°C
    7. Refractive Index: 1.501
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: (E)-oct-2-enedioic acid(CAS DataBase Reference)
    11. NIST Chemistry Reference: (E)-oct-2-enedioic acid(5698-50-0)
    12. EPA Substance Registry System: (E)-oct-2-enedioic acid(5698-50-0)
  • 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: 5698-50-0(Hazardous Substances Data)

5698-50-0 Usage

Uses

Used in Food Industry:
(E)-oct-2-enedioic acid is used as a flavoring agent for its tart taste, making it a popular additive in the production of beverages, desserts, and candy.
Used in Pharmaceutical Industry:
(E)-oct-2-enedioic acid is used as a starting material in the synthesis of various pharmaceutical compounds, contributing to the development of new drugs and treatments.
Used in Polymer Production:
Fumaric acid is utilized in the manufacturing of polymers, which have a wide range of applications in different industries, including plastics, coatings, and adhesives.
Used as a Precursor in Organic Synthesis:
(E)-oct-2-enedioic acid serves as a precursor in the synthesis of various organic compounds, enabling the creation of a diverse array of chemical products.
Used in Manufacturing Resins:
Fumaric acid is employed in the production of resins, which are used in various applications such as coatings, adhesives, and composite materials.
Used as a Precursor to Maleic Anhydride:
(E)-oct-2-enedioic acid is used in the manufacturing process of maleic anhydride, an important industrial chemical with applications in the production of plastics, resins, and other materials.
Used in Treatment of Skin Conditions:
Fumaric acid is also utilized in the treatment of certain skin conditions, providing therapeutic benefits for patients with specific dermatological issues.

Check Digit Verification of cas no

The CAS Registry Mumber 5698-50-0 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,6,9 and 8 respectively; the second part has 2 digits, 5 and 0 respectively.
Calculate Digit Verification of CAS Registry Number 5698-50:
(6*5)+(5*6)+(4*9)+(3*8)+(2*5)+(1*0)=130
130 % 10 = 0
So 5698-50-0 is a valid CAS Registry Number.
InChI:InChI=1/C8H12O4/c9-7(10)5-3-1-2-4-6-8(11)12/h3,5H,1-2,4,6H2,(H,9,10)(H,11,12)/b5-3-

5698-50-0SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-Octenedioic acid

1.2 Other means of identification

Product number -
Other names oct-2-enedioic acid

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:5698-50-0 SDS

5698-50-0Relevant articles and documents

EVIDENCE FOR A STEREOELECTRONIC EFFECT IN THE BAEYER-VILLIGER REACTION: INTRODUCING THE INTRAMOLECULAR REACTION

Chandrasekhar, Sosale,Roy, Chandra Deo

, p. 6371 - 6372 (1987)

An intramolecular Baeyer-Villiger reaction has been effected involving a conformationally-fixed intermediate which breaks down with stereoelectronic control.

Conformationally Restricted Criegee Intermediates: Evidence for Formation and Stereoelectronically Controlled Fragmentation

Chandrasekhar, Sosale,Roy, Chandra Deo

, p. 2141 - 2144 (2007/10/02)

The Bayer-Villiger reaction of 2-(2-oxocyclohexyl)acetic acid occurs via a bicyclic Criegee intermediate, which fragments with stereoelectronic control, as evidenced by product analysis; the reaction of the but-2-yl ester and of 2-(2-oxocyclopentyl)acetic acid also show evidence of such stereoelectronic control, but less convincingly.

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