Cas no 1162658-12-9 (Veratric Acid-d6)

Veratric Acid-d6 (3,4-Dimethoxybenzoic acid-d6) is a deuterated analog of veratric acid, where six hydrogen atoms are replaced with deuterium. This stable isotope-labeled compound is primarily used as an internal standard in quantitative mass spectrometry, ensuring high accuracy and precision in analytical applications such as metabolomics and pharmacokinetic studies. The deuterium substitution minimizes interference with the target analyte, enhancing signal resolution. Its high isotopic purity (>98%) and chemical stability make it suitable for use in complex biological matrices. Veratric Acid-d6 is particularly valuable in research requiring trace-level detection and reliable quantification of veratric acid or related metabolites.
Veratric Acid-d6 structure
Veratric Acid-d6 structure
Product Name:Veratric Acid-d6
CAS No:1162658-12-9
MF:C9H10O4
MW:188.210273265839
CID:1059723
PubChem ID:57792130
Update Time:2025-10-20

Veratric Acid-d6 Chemical and Physical Properties

Names and Identifiers

    • Veratric Acid-d6
    • 3,4-Bis(trideuteriomethoxy)benzoic acid
    • HY-N2007S
    • CS-0374585
    • 1162658-12-9
    • 3,4-Dimethoxybenzoic Acid-d6; Dimethylprotocatechuic Acid-d6; NSC 7721-d6;
    • SCHEMBL3662041
    • Inchi: 1S/C9H10O4/c1-12-7-4-3-6(9(10)11)5-8(7)13-2/h3-5H,1-2H3,(H,10,11)/i1D3,2D3
    • InChI Key: DAUAQNGYDSHRET-WFGJKAKNSA-N
    • SMILES: O(C([2H])([2H])[2H])C1C=C(C(=O)O)C=CC=1OC([2H])([2H])[2H]

Computed Properties

  • Exact Mass: 188.09556927g/mol
  • Monoisotopic Mass: 188.09556927g/mol
  • Isotope Atom Count: 6
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 3
  • Complexity: 181
  • 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: 1.6
  • Topological Polar Surface Area: 55.8?2

Veratric Acid-d6 Pricemore >>

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Additional information on Veratric Acid-d6

Comprehensive Guide to Veratric Acid-d6 (CAS No. 1162658-12-9): Properties, Applications, and Market Insights

Veratric Acid-d6 (CAS No. 1162658-12-9) is a deuterium-labeled analog of veratric acid, a naturally occurring compound found in plants such as Veratrum album. This stable isotope-labeled compound is widely used in pharmaceutical research, metabolomics, and analytical chemistry as an internal standard for mass spectrometry. The deuterium substitution at six positions enhances its utility in quantitative analysis, making it indispensable for drug metabolism studies and biomarker discovery.

The growing demand for isotope-labeled compounds in life sciences has positioned Veratric Acid-d6 as a critical tool for researchers. With the rise of precision medicine and personalized healthcare, the need for accurate metabolite quantification has never been higher. This compound plays a pivotal role in LC-MS/MS (liquid chromatography-tandem mass spectrometry) workflows, ensuring reliable data in clinical diagnostics and pharmacokinetic studies.

From a chemical perspective, Veratric Acid-d6 exhibits similar properties to its non-deuterated counterpart but with distinct advantages in isotope dilution mass spectrometry. Its molecular formula is C9D6H4O4, and it typically appears as a white to off-white crystalline powder. The compound is soluble in organic solvents like methanol and dimethyl sulfoxide (DMSO), making it compatible with various analytical techniques.

In recent years, Veratric Acid-d6 has gained attention in food safety testing and environmental analysis. As regulatory agencies worldwide tighten standards for contaminant detection, researchers increasingly rely on deuterated internal standards like Veratric Acid-d6 to achieve trace-level quantification. This trend aligns with the broader movement toward green chemistry and sustainable analytical methods.

The synthesis of Veratric Acid-d6 typically involves deuterium exchange reactions or labeled precursor incorporation. Manufacturers must maintain strict quality control to ensure isotopic purity, which is crucial for its performance as an internal standard. Current market trends show increasing demand for high-purity isotope-labeled standards, driven by advancements in proteomics and metabolomics technologies.

For researchers exploring natural product chemistry, Veratric Acid-d6 serves as a valuable reference compound when studying plant-derived metabolites. Its applications extend to nutraceutical research, where it helps quantify bioactive compounds in functional foods and dietary supplements. The compound's stability under various chromatographic conditions makes it particularly useful for method development in analytical laboratories.

Storage and handling of Veratric Acid-d6 require standard laboratory precautions. While not classified as hazardous, it should be stored in a cool, dry place, protected from light to maintain stability. The compound's shelf life can extend several years when properly stored, making it a cost-effective choice for long-term research projects.

The global market for isotope-labeled compounds like Veratric Acid-d6 continues to expand, with North America and Europe leading in consumption. However, emerging markets in Asia are showing rapid growth, particularly in pharmaceutical R&D and contract research organizations. This geographical shift reflects the increasing globalization of scientific research and drug development activities.

Looking ahead, innovations in analytical instrumentation and separation technologies will likely create new opportunities for Veratric Acid-d6 applications. The compound's versatility ensures its continued relevance across multiple scientific disciplines, from basic research to industrial quality control. As regulatory requirements become more stringent worldwide, the demand for reliable quantitative standards like Veratric Acid-d6 will only increase.

For laboratories considering Veratric Acid-d6 for their research needs, it's essential to source the compound from reputable suppliers who can provide comprehensive certificates of analysis and isotopic purity data. Proper validation of analytical methods using this standard can significantly enhance the reliability and reproducibility of experimental results across various applications in biomedical research and chemical analysis.

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