Cas no 827308-41-8 (4-Benzyloxy-7-13Cbenzaldehyde)

4-Benzyloxy-7-13Cbenzaldehyde is a stable isotope-labeled aromatic aldehyde, where the carbon-13 (13C) label is incorporated at the 7-position of the benzaldehyde ring. This compound is particularly valuable in synthetic organic chemistry and pharmaceutical research, serving as a key intermediate in the preparation of isotopically labeled compounds for metabolic studies, NMR spectroscopy, and tracer applications. The benzyloxy group enhances solubility and reactivity, facilitating selective functionalization. The 13C labeling provides a distinct spectroscopic signature, enabling precise tracking in reaction mechanisms or biological pathways. Its high isotopic purity and well-defined structure make it a reliable choice for researchers requiring labeled building blocks with consistent performance.
4-Benzyloxy-7-13Cbenzaldehyde structure
4-Benzyloxy-7-13Cbenzaldehyde structure
Product Name:4-Benzyloxy-7-13Cbenzaldehyde
CAS No:827308-41-8
MF:C14H12O2
MW:213.236538887024
CID:988110
PubChem ID:45038301
Update Time:2025-06-11

4-Benzyloxy-7-13Cbenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 4-Benzyloxy-[7-13C]benzaldehyde
    • 4-phenylmethoxybenzaldehyde
    • 4-(Benzyloxy)(formyl-~13~C)benzaldehyde
    • 827308-41-8
    • DTXSID70661804
    • AKOS030242849
    • 4-Benzyloxy-7-13Cbenzaldehyde
    • Inchi: 1S/C14H12O2/c15-10-12-6-8-14(9-7-12)16-11-13-4-2-1-3-5-13/h1-10H,11H2/i10+1
    • InChI Key: ZVTWZSXLLMNMQC-DETAZLGJSA-N
    • SMILES: O(C1C=CC([13CH]=O)=CC=1)CC1C=CC=CC=1

Computed Properties

  • Exact Mass: 213.08700
  • Monoisotopic Mass: 213.087084457g/mol
  • Isotope Atom Count: 1
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 4
  • Complexity: 201
  • 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: 3.3
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.30000
  • LogP: 3.07810

4-Benzyloxy-7-13Cbenzaldehyde Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
B285877-5mg
4-Benzyloxy-[7-13C]benzaldehyde
827308-41-8
5mg
$ 190.00 2023-04-18
TRC
B285877-100mg
4-Benzyloxy-[7-13C]benzaldehyde
827308-41-8
100mg
$ 1487.00 2023-04-18

Additional information on 4-Benzyloxy-7-13Cbenzaldehyde

Comprehensive Analysis of 4-Benzyloxy-7-13Cbenzaldehyde (CAS No. 827308-41-8): Applications and Innovations

4-Benzyloxy-7-13Cbenzaldehyde (CAS No. 827308-41-8) is a carbon-13 labeled aromatic aldehyde widely utilized in pharmaceutical research, organic synthesis, and isotopic labeling studies. This compound features a benzyloxy group at the 4-position and a 13C isotope at the 7-position, making it invaluable for NMR spectroscopy and metabolic pathway tracing. Its unique structure enables precise tracking in drug metabolism and biochemical assays, aligning with the growing demand for stable isotope-labeled compounds in life sciences.

The rise of precision medicine and personalized therapeutics has amplified interest in isotopically labeled intermediates like 4-Benzyloxy-7-13Cbenzaldehyde. Researchers frequently search for "carbon-13 labeled benzaldehyde derivatives" or "applications of 13C in drug development," reflecting its relevance in AI-driven drug discovery and green chemistry. The compound’s role in high-throughput screening and bioconjugation further underscores its versatility.

Synthetically, 827308-41-8 serves as a precursor for chiral auxiliaries and fluorescence probes. Its benzyl-protected aldehyde moiety allows selective deprotection, enabling modular synthesis of complex molecules. Recent publications highlight its use in catalysis and material science, particularly in designing smart polymers and bioimaging agents.

From an SEO perspective, trending queries such as "buy 4-Benzyloxy-7-13Cbenzaldehyde" or "CAS 827308-41-8 suppliers" indicate commercial demand. Regulatory-compliant synthesis and scalable production methods are key discussion points, as industries prioritize sustainable sourcing and cost-effective labeling techniques.

In conclusion, 4-Benzyloxy-7-13Cbenzaldehyde bridges gaps between fundamental research and industrial applications. Its integration into cutting-edge technologies like CRISPR-based diagnostics and nanomedicine positions it as a critical tool for future scientific breakthroughs.

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