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2,3-Butanedione trimer, also known as diacetyl trimer, is a chemical compound with a distinct buttery aroma. It is formed by the condensation of three molecules of 2,3-butanedione, resulting in a compound with a strong, fatty odor. The compound is characterized by its high strength odor and is commonly used in the flavor and fragrance industry due to its ability to impart a buttery note to various products.

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  • 18114-49-3 Structure
  • Basic information

    1. Product Name: 2,3-butanedione trimer
    2. Synonyms: 2,3-butanedione trimer;1,1'-(TETRAHYDRO-6A-HYDROXY-2,3A,5- TRIMETHYLFURO[2,3-D]-1,3-DIOXOLE-2,5-DIYL)BIS-ETHANONE
    3. CAS NO:18114-49-3
    4. Molecular Formula: C12H18O6
    5. Molecular Weight: 258.26772
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 18114-49-3.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 370.2 °C at 760 mmHg
    3. Flash Point: 137.5 °C
    4. Appearance: /
    5. Density: 1.279 g/cm3
    6. Vapor Pressure: 5.47E-07mmHg at 25°C
    7. Refractive Index: 1.502
    8. Storage Temp.: N/A
    9. Solubility: N/A
    10. CAS DataBase Reference: 2,3-butanedione trimer(CAS DataBase Reference)
    11. NIST Chemistry Reference: 2,3-butanedione trimer(18114-49-3)
    12. EPA Substance Registry System: 2,3-butanedione trimer(18114-49-3)
  • 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: 18114-49-3(Hazardous Substances Data)

18114-49-3 Usage

Uses

Used in Flavor Industry:
2,3-Butanedione trimer is used as a flavoring agent for its characteristic buttery aroma. It is added to a wide range of food products, such as popcorn, baked goods, and dairy products, to enhance their flavor and provide a rich, creamy taste. The compound is used in small quantities, with an aroma threshold value of 0.10% solution or less, to achieve the desired effect without overpowering the other flavors in the product.
Used in Fragrance Industry:
In addition to its use in the flavor industry, 2,3-butanedione trimer is also employed as a fragrance ingredient. Its buttery aroma can be used to create a warm, comforting scent in various personal care products, such as perfumes, lotions, and candles. The compound's high strength odor allows it to be used in small amounts, making it an efficient and cost-effective option for fragrance formulations.

Check Digit Verification of cas no

The CAS Registry Mumber 18114-49-3 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 1,8,1,1 and 4 respectively; the second part has 2 digits, 4 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 18114-49:
(7*1)+(6*8)+(5*1)+(4*1)+(3*4)+(2*4)+(1*9)=93
93 % 10 = 3
So 18114-49-3 is a valid CAS Registry Number.
InChI:InChI=1/C12H18O6/c1-7(13)9(3)6-12(15)11(5,16-9)17-10(4,18-12)8(2)14/h15H,6H2,1-5H3

18114-49-3SDS

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 2,3-Butanedione trimer

1.2 Other means of identification

Product number -
Other names -

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:18114-49-3 SDS

18114-49-3Upstream product

18114-49-3Relevant articles and documents

THE STEREOSTRUCTURE OF TWO TRIMERS OF BIACETYL

Poje, M.,Perina, I.,Vickovic, I.,Bruvo, M.

, p. 1985 - 1988 (2007/10/02)

Structures of two trimers of biacetyl were determined on the basis of chemical and spectroscopic evidence and the single-crystal X-ray analysis.The compounds are shown to be exo-3,endo-7-diacetyl-1-hydroxy-endo-3,5,exo-7-trimethyl-cis-2,4,6-trioxabicyclooctane (2) and 11-hydroxy-1,3,5,7,11-pentamethyl-cis-2,4,6,8-tetraoxatricyclo3,7>undecan-9-one (3).

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