Cas no 21388-65-8 (Isopropanol-13C)

Isopropanol-13C is a stable isotope-labeled variant of isopropanol, where the carbon atom is replaced by the 13C isotope. This compound is primarily utilized as a tracer in nuclear magnetic resonance (NMR) spectroscopy and mass spectrometry (MS) studies, enabling precise tracking of molecular interactions and metabolic pathways. Its isotopic purity ensures minimal interference in analytical applications, enhancing accuracy in structural elucidation and quantitative analysis. Isopropanol-13C is also employed in research involving isotopic dilution and kinetic studies, offering reliable data reproducibility. The compound’s compatibility with organic synthesis further expands its utility in labeled intermediate preparation for pharmaceutical and biochemical research.
Isopropanol-13C structure
Isopropanol-13C structure
Product Name:Isopropanol-13C
CAS No:21388-65-8
MF:C3H8O
MW:61.0876760482788
CID:242297
PubChem ID:16213337
Update Time:2025-06-09

Isopropanol-13C Chemical and Physical Properties

Names and Identifiers

    • 2-Propanol-2-13C (9CI)
    • (2-13C)-2-Hydroxypropan
    • (RS)-< 2-(13)C> Mevalonolactone
    • [2-13C]Mevalolactone
    • [2-13C]-mevalonolactone
    • [2-13C]propan-2-ol
    • < 2-(13)C> -mevalonolactone
    • < 2-13C> -mevalonolactone
    • 13C labeled 2-propanol
    • 486604_ALDRICH
    • DL-Mevalonic-2-13C lactone
    • I14-45895
    • Mevalonolacton-2-13C
    • Mevalonolactone-2-13C
    • (213C)propan-2-ol
    • AKOS015913282
    • 21388-65-8
    • 2-Propanol-2-13C
    • Isopropanol-13C
    • 2-Propanol-2-13C, 99 atom % 13C
    • Inchi: 1S/C3H8O/c1-3(2)4/h3-4H,1-2H3/i3+1
    • InChI Key: KFZMGEQAYNKOFK-LBPDFUHNSA-N
    • SMILES: O[13CH](C)C

Computed Properties

  • Exact Mass: 61.060869710g/mol
  • Monoisotopic Mass: 61.060869710g/mol
  • Isotope Atom Count: 1
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 4
  • Rotatable Bond Count: 0
  • Complexity: 10.8
  • 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: 0.3
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • Color/Form: liquid
  • Density: 0.798?g/mL?at 25?°C
  • Melting Point: ?89.5?°C(lit.)
  • Boiling Point: 82?°C(lit.)
  • Flash Point: 53?°F
  • Refractive Index: n20/D 1.377(lit.)
  • PSA: 20.23000
  • LogP: 0.38710
  • Solubility: Not determined

Isopropanol-13C Security Information

  • Hazardous Material transportation number:UN 1219 3/PG 2
  • WGK Germany:3
  • Hazard Category Code: 11-67-36
  • Safety Instruction: 7-16-26-24/25
  • Hazardous Material Identification: F
  • Risk Phrases:11

Isopropanol-13C Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
I822878-5mg
Isopropanol-13C
21388-65-8
5mg
$ 58.00 2023-09-07
TRC
I822878-10mg
Isopropanol-13C
21388-65-8
10mg
$ 81.00 2023-09-07
TRC
I822878-50mg
Isopropanol-13C
21388-65-8
50mg
$ 293.00 2023-09-07

Additional information on Isopropanol-13C

Comprehensive Guide to Isopropanol-13C (CAS No. 21388-65-8): Applications, Properties, and Industry Insights

Isopropanol-13C, labeled with the stable isotope carbon-13 (13C), is a specialized chemical compound widely utilized in research, pharmaceuticals, and analytical chemistry. With the CAS registry number 21388-65-8, this isotopically enriched variant of isopropanol offers unique advantages in tracing metabolic pathways, NMR spectroscopy, and quantitative analysis. Its molecular structure, featuring a 13C atom at the carbonyl position, enhances detection sensitivity and accuracy in advanced scientific applications.

The growing demand for isotope-labeled compounds like Isopropanol-13C is driven by breakthroughs in drug development and environmental studies. Researchers frequently search for "13C-labeled solvents for NMR" or "stable isotope applications in metabolomics," reflecting its critical role in modern laboratories. Unlike conventional isopropanol, the 13C version eliminates signal overlap in spectra, making it indispensable for structural elucidation and kinetic studies.

From a synthetic perspective, Isopropanol-13C (CAS 21388-65-8) is produced through meticulous isotopic enrichment processes, ensuring high chemical purity (>98%) and isotopic abundance (>99% 13C). These specifications cater to stringent requirements in pharmaceutical impurity profiling and biochemical tracer studies. Industry trends show increased interest in "green chemistry alternatives," where 13C-labeled reagents reduce waste by enabling precise reaction monitoring.

Analytical techniques such as LC-MS and GC-IRMS heavily rely on Isopropanol-13C as an internal standard. Recent publications highlight its utility in "carbon flux analysis" and "protein interaction mapping," addressing key questions like "How does 13C labeling improve drug metabolism studies?" This aligns with the broader shift toward precision medicine, where isotopic labeling accelerates biomarker discovery.

Storage and handling of Isopropanol-13C (CAS 21388-65-8) require adherence to standard laboratory protocols for organic solvents. Its compatibility with deuterated solvents (e.g., DMSO-d6) expands its use in multi-dimensional NMR experiments. Notably, forums discussing "best practices for handling labeled compounds" emphasize the need for moisture-free environments to maintain isotopic integrity.

Emerging applications in catalysis research and renewable energy further underscore the versatility of Isopropanol-13C. For instance, studies on "13C-isotope effects in photocatalytic reactions" exploit its unique properties to optimize reaction mechanisms. This positions the compound as a pivotal tool in sustainable technology development.

In summary, Isopropanol-13C (CAS 21388-65-8) bridges fundamental research and industrial innovation. Its alignment with trending topics like "advanced analytical methodologies" and "isotope-assisted drug design" ensures continued relevance. As laboratories prioritize accuracy and sustainability, the demand for high-purity 13C-labeled chemicals will undoubtedly rise.

Recommended suppliers
Hebei Liye chemical Co.,Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Hebei Liye chemical Co.,Ltd
Beyond Pharmaceutical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Reagent
ASIACHEM I&E (JIANGSU) CO., LTD
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
ASIACHEM I&E (JIANGSU) CO., LTD
Nanjing jingzhu bio-technology Co., Ltd.
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Nanjing jingzhu bio-technology Co., Ltd.
Jiangxi Boyang Pharmaceutical Chemical Co., Ltd
Gold Member
Audited Supplier Audited Supplier
CN Supplier
Bulk
Jiangxi Boyang Pharmaceutical Chemical Co., Ltd