Cas no 35845-63-7 (Phenethyl Alcohol-d5)

Phenethyl Alcohol-d5 (C6D5CH2CH2OH) is a deuterated analog of phenethyl alcohol, where five hydrogen atoms are replaced with deuterium. This stable isotopically labeled compound is primarily used as an internal standard in mass spectrometry and NMR spectroscopy, ensuring precise quantification and reduced interference in analytical applications. Its high isotopic purity (>98%) and chemical stability make it particularly valuable in metabolic studies, fragrance analysis, and pharmaceutical research. The incorporation of deuterium minimizes spectral overlap, enhancing detection sensitivity and accuracy. Phenethyl Alcohol-d5 is compatible with organic solvents and exhibits consistent performance in complex matrices, supporting reliable data interpretation in isotopic labeling experiments.
Phenethyl Alcohol-d5 structure
Phenethyl Alcohol-d5 structure
Product Name:Phenethyl Alcohol-d5
CAS No:35845-63-7
MF:C8H10O
MW:127.195210933685
MDL:MFCD01861589
CID:304577
PubChem ID:11672668
Update Time:2025-10-25

Phenethyl Alcohol-d5 Chemical and Physical Properties

Names and Identifiers

    • Benzene-d5-ethanol(9CI)
    • 2-(Pentadeuterophenyl)ethanol
    • Phenethyl Alcohol-d5
    • 2-(Phenyl-d5)ethan-1-ol
    • HY-B1290S2
    • A935648
    • Benzeneethanol-d5
    • 2-(2,3,4,5,6-pentadeuteriophenyl)ethanol
    • 2-Phenyl-d5-ethanol, 98 atom % D, 98% (CP)
    • 2-PHENYL-D5-ETHANOL
    • 2-Phenylethanol-d5
    • DTXSID40470349
    • D99601
    • 35845-63-7
    • CS-0572636
    • 2-Phenyl-d5-ethanol:(35845-63-7)
    • MDL： MFCD01861589
    • Inchi： 1S/C8H10O/c9-7-6-8-4-2-1-3-5-8/h1-5,9H,6-7H2/i1D,2D,3D,4D,5D
    • InChI Key： WRMNZCZEMHIOCP-RALIUCGRSA-N
    • SMILES： OCCC1C([2H])=C([2H])C([2H])=C([2H])C=1[2H]

Computed Properties

  • Exact Mass: 127.104548668g/mol
  • Monoisotopic Mass: 127.104548668g/mol
  • Isotope Atom Count: 5
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 2
  • Complexity: 65
  • 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: 1.4
  • Topological Polar Surface Area: 20.2?2

Experimental Properties

  • Color/Form: No data avaiable
  • Density: 1.0±0.1 g/cm3
  • Melting Point: No data available
  • Boiling Point: 218.2±8.0 °C at 760 mmHg
  • Flash Point: 102.2±0.0 °C
  • Vapor Pressure: No data available

Phenethyl Alcohol-d5 Security Information

Phenethyl Alcohol-d5 Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
P296002-100mg
Phenethyl Alcohol-d5
 35845-63-7
100mg
 $ 222.00 2023-09-06
TRC
P296002-1g
Phenethyl Alcohol-d5
 35845-63-7
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 $ 1654.00 2023-09-06
AstaTech
D99601-0.1/G
2-PHENYL-D5-ETHANOL
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0.1g
 $294 2023-09-19
AstaTech
D99601-0.25/G
2-PHENYL-D5-ETHANOL
 35845-63-7 95%
0.25g
 $387 2023-09-19
AstaTech
D99601-1/G
2-PHENYL-D5-ETHANOL
 35845-63-7 95%
1g
 $555 2023-09-19
A2B Chem LLC
AX38156-500mg
PhenethylAlcohol-d5
 35845-63-7
500mg
 $433.00 2024-04-20
A2B Chem LLC
AX38156-1g
PhenethylAlcohol-d5
 35845-63-7
1g
 $621.00 2024-04-20

Phenethyl Alcohol-d5 Related Literature

Related Categories

Additional information on Phenethyl Alcohol-d5

Comprehensive Analysis of Phenethyl Alcohol-d5 (CAS No. 35845-63-7): Applications and Insights

Phenethyl Alcohol-d5, also known as deuterated phenethyl alcohol, is a stable isotope-labeled compound widely utilized in analytical chemistry, pharmaceuticals, and fragrance research. With the CAS registry number 35845-63-7, this deuterated variant of phenethyl alcohol offers unique advantages in mass spectrometry and nuclear magnetic resonance (NMR) studies due to its isotopic purity. The growing demand for deuterated compounds in metabolic research and drug development has positioned Phenethyl Alcohol-d5 as a critical tool for scientists.

One of the primary applications of Phenethyl Alcohol-d5 is as an internal standard in quantitative analysis. Its deuterium atoms provide a distinct mass shift, enabling precise detection in complex matrices like biological fluids or environmental samples. Researchers leverage this property to study metabolic pathways or quantify trace amounts of phenethyl alcohol in consumer products. The compound’s stability under experimental conditions further enhances its reliability in long-term studies.

In the fragrance industry, Phenethyl Alcohol-d5 serves as a reference material for quality control. With increasing consumer awareness about synthetic vs. natural ingredients, manufacturers use deuterated analogs to authenticate product compositions. This aligns with the trending search queries like “how to identify artificial fragrances” or “role of isotopes in perfume testing.” By incorporating Phenethyl Alcohol-d5, brands ensure transparency and compliance with regulatory standards.

Recent advancements in AI-driven drug discovery have also spotlighted deuterated compounds. Phenethyl Alcohol-d5 aids in modeling molecular interactions, addressing popular questions such as “how does deuterium improve drug stability?” Its ability to mimic native molecules while providing detectable signatures makes it invaluable for high-throughput screening platforms. This synergy between traditional chemistry and modern technology underscores the compound’s versatility.

From an environmental perspective, Phenethyl Alcohol-d5 contributes to green chemistry initiatives. Laboratories increasingly adopt isotope-labeled reagents to minimize waste, resonating with searches like “sustainable lab practices.” The compound’s role in reducing redundant experiments aligns with global efforts to optimize resource efficiency—a key concern for academic and industrial researchers alike.

In summary, Phenethyl Alcohol-d5 (CAS 35845-63-7) bridges multiple scientific disciplines, from analytical methodologies to consumer product safety. Its integration into cutting-edge research and response to industry trends ensures continued relevance. As interest in isotope applications grows, this compound remains a cornerstone for innovation.

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