Cas no 1078126-79-0 (Diethyl Carbonate-13C5)

Diethyl Carbonate-13C5 is a stable isotope-labeled compound where all five carbon atoms are replaced with carbon-13 (13C), providing a distinct molecular signature for analytical applications. This high-purity compound is particularly valuable in nuclear magnetic resonance (NMR) spectroscopy and mass spectrometry (MS) as an internal standard or tracer, ensuring precise quantification and metabolic pathway studies. Its isotopic enrichment enhances sensitivity and reduces background interference in labeled experiments. Diethyl Carbonate-13C5 is also used in organic synthesis for introducing 13C-labeled ethyl groups. The compound’s consistent isotopic purity and chemical stability make it a reliable choice for research in pharmaceuticals, biochemistry, and environmental analysis.
Diethyl Carbonate-13C5 structure
Diethyl Carbonate-13C5 structure
Product Name:Diethyl Carbonate-13C5
CAS No:1078126-79-0
MF:C5H10O3
MW:123.094376087189
CID:1062858
PubChem ID:71309515
Update Time:2025-05-24

Diethyl Carbonate-13C5 Chemical and Physical Properties

Names and Identifiers

    • Diethyl Carbonate-13C5
    • diethyl carbonate
    • Diethyl carbonate-13C5, 98 atom % 13C, 97% (CP)
    • Bis[(~13~C_2_)ethyl] (~13~C)carbonate
    • di(1,2-13C2)ethyl carbonate
    • SCHEMBL1332089
    • DTXSID70745911
    • 1078126-79-0
    • Inchi: 1S/C5H10O3/c1-3-7-5(6)8-4-2/h3-4H2,1-2H3/i1+1,2+1,3+1,4+1,5+1
    • InChI Key: OIFBSDVPJOWBCH-CVMUNTFWSA-N
    • SMILES: O([13C](=O)O[13CH2][13CH3])[13CH2][13CH3]

Computed Properties

  • Exact Mass: 123.07976835g/mol
  • Monoisotopic Mass: 123.07976835g/mol
  • Isotope Atom Count: 5
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 8
  • Rotatable Bond Count: 4
  • Complexity: 62.1
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.2
  • Topological Polar Surface Area: 35.5?2

Experimental Properties

  • Density: 1.015?g/mL?at 25?°C
  • Melting Point: -43?°C(lit.)
  • Boiling Point: 126-128?°C(lit.)
  • Flash Point: 25?°C

Diethyl Carbonate-13C5 Security Information

  • Hazardous Material transportation number:UN 2366 3/PG 3
  • Hazard Category Code: 10-36/37/38
  • Safety Instruction: 16-23-26-36
  • Hazardous Material Identification: Xi

Diethyl Carbonate-13C5 Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
D444002-10mg
Diethyl Carbonate-13C5
1078126-79-0
10mg
$207.00 2023-05-18
TRC
D444002-100mg
Diethyl Carbonate-13C5
1078126-79-0
100mg
$1642.00 2023-05-18
A2B Chem LLC
AE14284-1g
Diethyl carbonate-13C5
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$2913.00 2024-04-20

Additional information on Diethyl Carbonate-13C5

Diethyl Carbonate-13C5: A Comprehensive Overview

Diethyl Carbonate-13C5, also known by its CAS number 1078126-79-0, is a compound of significant interest in various scientific and industrial applications. This compound is a derivative of diethyl carbonate, with the unique feature of incorporating five 13C isotopes. The integration of these isotopes provides distinct advantages in research and development, particularly in fields such as metabolomics, pharmacokinetics, and environmental science.

The synthesis of Diethyl Carbonate-13C5 involves advanced chemical processes that ensure the precise incorporation of the 13C isotopes. This process is critical to maintaining the compound's stability and functionality. Recent studies have highlighted the importance of isotopic labeling in enhancing the accuracy of analytical techniques, such as mass spectrometry. By using Diethyl Carbonate-13C5, researchers can achieve higher resolution and sensitivity in their analyses, leading to more reliable results.

In the field of pharmacology, Diethyl Carbonate-13C5 has been utilized as a stable isotope tracer. This application is particularly valuable in studying drug metabolism and bioavailability. For instance, a 2023 study published in the Journal of Pharmaceutical Sciences demonstrated how Diethyl Carbonate-13C5 was employed to track the metabolic pathways of a novel drug candidate. The study revealed that the use of isotopically labeled compounds significantly improved the precision of metabolic profiling.

Beyond pharmacology, Diethyl Carbonate-13C5 has found applications in environmental research. Its role as a tracer in soil and water studies has provided insights into contaminant transport and degradation mechanisms. A recent project conducted by environmental scientists at Stanford University utilized Diethyl Carbonate-13C5 to monitor the biodegradation of organic pollutants in aqueous environments. The results underscored the compound's effectiveness in tracking environmental processes with high accuracy.

The demand for Diethyl Carbonate-13C5 has grown steadily due to its versatility and reliability as an isotopic tracer. Manufacturers have responded by improving production methods to meet this demand while ensuring product quality and safety. Innovations in synthesis techniques have also led to cost reductions, making this compound more accessible to researchers worldwide.

In conclusion, Diethyl Carbonate-13C5, with its CAS number 1078126-79-0, stands as a vital tool in modern scientific research. Its applications span across multiple disciplines, driven by advancements in isotopic labeling technology. As research continues to uncover new uses for this compound, its role in scientific innovation is expected to expand further.

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