Cas no 352439-04-4 (PROPIONYL-D5 CHLORIDE)
PROPIONYL-D5 CHLORIDE Chemical and Physical Properties
Names and Identifiers
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- PROPIONYL-D5 CHLORIDE
- Propanoyl-D5 Chloride
- 352439-04-4
- (?H?)propanoyl chloride
- 2,2,3,3,3-Pentadeuteriopropanoyl chloride
- Propanoyl-d5 chloride (9CI); Propionyl-d5 chloride; Propionyl-D5 chloride; Propionic acid chloride-d5; Propionyl chloride-d5; Propionyl-2,2,3,3,3-d5 chloride
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- Inchi: 1S/C3H5ClO/c1-2-3(4)5/h2H2,1H3/i1D3,2D2
- InChI Key: RZWZRACFZGVKFM-ZBJDZAJPSA-N
- SMILES: ClC(C([2H])([2H])C([2H])([2H])[2H])=O
Computed Properties
- Exact Mass: 97.0342762g/mol
- Monoisotopic Mass: 97.0342762g/mol
- Isotope Atom Count: 5
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 5
- Rotatable Bond Count: 1
- Complexity: 42.2
- 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: 17.1?2
PROPIONYL-D5 CHLORIDE Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| SHANG HAI HAO HONG Biomedical Technology Co., Ltd. | 2109077-250mg |
Propanoyl-d5 chloride |
352439-04-4 | 250mg |
¥3600.00 | 2024-05-17 | ||
| A2B Chem LLC | AF66863-100mg |
PROPIONYL-D5 CHLORIDE |
352439-04-4 | 100mg |
$575.00 | 2024-04-20 | ||
| A2B Chem LLC | AF66863-250mg |
PROPIONYL-D5 CHLORIDE |
352439-04-4 | 250mg |
$766.00 | 2024-04-20 | ||
| SHENG KE LU SI SHENG WU JI SHU | sc-476234-100mg |
Propanoyl-D5 Chloride, |
352439-04-4 | 100mg |
¥2256.00 | 2023-09-05 | ||
| SHENG KE LU SI SHENG WU JI SHU | sc-476234-100 mg |
Propanoyl-D5 Chloride, |
352439-04-4 | 100MG |
¥2,256.00 | 2023-07-10 |
PROPIONYL-D5 CHLORIDE Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
Additional information on PROPIONYL-D5 CHLORIDE
Research Brief on PROPIONYL-D5 CHLORIDE (CAS: 352439-04-4) in Chemical and Biomedical Applications
PROPIONYL-D5 CHLORIDE (CAS: 352439-04-4) is a deuterium-labeled derivative of propionyl chloride, a key intermediate in pharmaceutical synthesis and metabolic studies. Recent research has highlighted its growing importance in drug development, particularly in the context of stable isotope labeling for mass spectrometry-based assays and pharmacokinetic studies. This brief synthesizes the latest findings on its applications, synthetic routes, and safety profiles.
A 2023 study published in the Journal of Labelled Compounds and Radiopharmaceuticals demonstrated the utility of PROPIONYL-D5 CHLORIDE in the synthesis of deuterated analogs of nonsteroidal anti-inflammatory drugs (NSAIDs). The deuterium labeling at the propionyl moiety significantly improved metabolic stability while maintaining pharmacological activity, offering a promising strategy to extend drug half-lives. The study reported a 40% reduction in first-pass metabolism for deuterated ibuprofen derivatives compared to their non-deuterated counterparts.
In analytical chemistry applications, PROPIONYL-D5 CHLORIDE has emerged as a crucial internal standard for quantifying short-chain fatty acids (SCFAs) in gut microbiome research. A recent Analytical Chemistry paper (2024) detailed a novel derivatization protocol using this compound, achieving detection limits of 0.1 nM for propionate in complex biological matrices. The method's robustness was validated across 500+ human stool samples, demonstrating <5% inter-day variability.
The compound's safety profile was comprehensively reviewed in a 2024 regulatory assessment by the European Chemicals Agency (ECHA). While PROPIONYL-D5 CHLORIDE shares the corrosive properties of its non-deuterated form, its reduced volatility (measured at 30% lower vapor pressure) and slower hydrolysis kinetics suggest improved handling characteristics. Current Good Manufacturing Practice (cGMP) synthesis protocols have been established by three major contract research organizations, with purity specifications now exceeding 99.5% deuterium incorporation.
Emerging applications in positron emission tomography (PET) tracer development were highlighted at the 2024 Society of Nuclear Medicine conference. Researchers from MIT presented a novel carbon-11 labeling approach using PROPIONYL-D5 CHLORIDE as a precursor, achieving 85% radiochemical yield for a new class of neurodegeneration biomarkers. This builds upon earlier work with the compound in fluorine-18 labeling chemistry published in Nuclear Medicine and Biology.
From a commercial perspective, the global market for PROPIONYL-D5 CHLORIDE is projected to grow at 12.4% CAGR through 2030 (MarketsandMarkets 2024 report), driven by increasing demand in metabolic flux analysis and fragment-based drug design. Current price benchmarks range from $1,200-$1,800 per gram at research quantities, with lead times from specialty suppliers averaging 4-6 weeks due to complex purification requirements.
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