Cas no 136954-20-6 (3-Sulfanylhexyl Acetate)
3-Sulfanylhexyl Acetate Chemical and Physical Properties
Names and Identifiers
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- 3-Mercaptohexyl acetate
- HEXANE-3-THIOL ACETATE
- FEMA 3851
- 3-THIOHEXYL ACETATE
- 3-Sulfanylhexyl acetate
- 3-mercaptohexyl-acetate,3-mercapto-1-hexanol-1-acetate
- 3-mercapto-1-hexanol acetate
- 3-Sulfanylhexyl Acet
- Acetic Acid 3-Mercaptohexyl Ester
- 1-Hexanol, 3-mercapto-, 1-acetate
- 1-Hexanol, 3-mercapto-,1-acetate
- 3-mercapto-1-hexanolacetate
- 3-Sulphanylhexyl acetate
- 3-Sulfanylhexyl acetate #
- 3-Mercaptohex-1-yl acetate
- (S)-3-Mercaptohexyl acetate
- Jsp002226
- JUCARGIKESIVLB-UHFFFAOYSA-N
- 3- Mercapto-1-hexanol-1-acetate
- 3-Sulfanylhexylacetate
- 3-Sulfanylhexyl Acetate
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- MDL: MFCD00792516
- Inchi: 1S/C8H16O2S/c1-3-4-8(11)5-6-10-7(2)9/h8,11H,3-6H2,1-2H3
- InChI Key: JUCARGIKESIVLB-UHFFFAOYSA-N
- SMILES: S([H])C([H])(C([H])([H])C([H])([H])OC(C([H])([H])[H])=O)C([H])([H])C([H])([H])C([H])([H])[H]
Computed Properties
- Exact Mass: 176.08700
- Monoisotopic Mass: 176.0871
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 11
- Rotatable Bond Count: 6
- Complexity: 115
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 27.3
Experimental Properties
- Color/Form: Colorless transparent liquid
- Density: 0.987
- Boiling Point: 235.7 oC at 760 mmHg
- Flash Point: 109.8 oC
- Refractive Index: 1.4560 to 1.4600
- PSA: 65.10000
- LogP: 2.03810
- FEMA: 3851
3-Sulfanylhexyl Acetate Security Information
-
Symbol:
- Prompt:warning
- Hazard Statement: H315-H319
- Warning Statement: P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
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Hazardous Material Identification:
3-Sulfanylhexyl Acetate Customs Data
- HS CODE:2930909090
- Customs Data:
China Customs Code:
2930909090Overview:
2930909090. Other organic sulfur compounds. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%
Declaration elements:
Product Name, component content, use to
Summary:
2930909090. other organo-sulphur compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%
3-Sulfanylhexyl Acetate Pricemore >>
| Related Categories | No. | Product Name | Cas No. | Purity | Specification | Price | update time | Inquiry |
|---|---|---|---|---|---|---|---|---|
| TRC | S689105-5g |
3-Sulfanylhexyl Acetate |
136954-20-6 | 5g |
$ 141.00 | 2023-09-06 | ||
| TRC | S689105-10g |
3-Sulfanylhexyl Acetate |
136954-20-6 | 10g |
$184.00 | 2023-05-17 | ||
| TRC | S689105-25g |
3-Sulfanylhexyl Acetate |
136954-20-6 | 25g |
$ 300.00 | 2022-06-03 | ||
| TRC | S689105-50g |
3-Sulfanylhexyl Acetate |
136954-20-6 | 50g |
$580.00 | 2023-05-17 | ||
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | M2497-25g |
3-Sulfanylhexyl Acetate |
136954-20-6 | 97.0%(GC) | 25g |
¥2080.0 | 2022-06-10 | |
| SHANG HAI XIAN DING Biotechnology Co., Ltd. | M2497-5g |
3-Sulfanylhexyl Acetate |
136954-20-6 | 97.0%(GC) | 5g |
¥650.0 | 2022-06-10 | |
| SHANG HAI MAI KE LIN SHENG HUA Technology Co., Ltd. | M864542-1g |
3-Mercaptohexyl Acetate |
136954-20-6 | >97.0%(GC) | 1g |
¥176.00 | 2022-01-11 | |
| Apollo Scientific | OR5751-1g |
3-Thiohex-1-yl acetate |
136954-20-6 | 95 | 1g |
£36.00 | 2025-02-20 | |
| abcr | AB246751-5 g |
Hexane-3-thiol acetate, 95%; . |
136954-20-6 | 95% | 5 g |
€84.90 | 2023-07-20 | |
| abcr | AB246751-25 g |
Hexane-3-thiol acetate, 95%; . |
136954-20-6 | 95% | 25 g |
€278.40 | 2023-07-20 |
3-Sulfanylhexyl Acetate Suppliers
3-Sulfanylhexyl Acetate Related Literature
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1. Direct coupling of paper spray mass spectrometry and four-phase electroextraction sample preparationVictoria Silva Amador,Juliane Soares Moreira,Rodinei Augusti,Ricardo Mathias Orlando,Evandro Piccin Analyst 2021 146 1057
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Chunchun Li,Yiming Huang,Xinyuan Li,Yingrui Zhang,Qinglu Chen,Ziwei Ye,Zarah Alqarni,Steven E. J. Bell,Yikai Xu J. Mater. Chem. C 2021 9 11517
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Pavla Polá?ková,Julian Herszage,Susan E. Ebeler Chem. Soc. Rev. 2008 37 2478
Related Categories
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Carboxylic acid esters
- Solvents and Organic Chemicals Organic Compounds Organic acids and derivatives Carboxylic acids and derivatives Carboxylic acid derivatives Carboxylic acid esters
- Solvents and Organic Chemicals Organic Compounds Acids/Esters
- Other Chemical Reagents
Additional information on 3-Sulfanylhexyl Acetate
Recent Advances in the Study of 3-Sulfanylhexyl Acetate (CAS: 136954-20-6) in Chemical Biology and Pharmaceutical Research
3-Sulfanylhexyl Acetate (CAS: 136954-20-6) is a sulfur-containing ester compound that has garnered significant attention in recent years due to its unique chemical properties and potential applications in the fields of chemical biology and pharmaceuticals. This research brief aims to synthesize the latest findings on this compound, focusing on its synthesis, biological activities, and potential therapeutic applications. The compound's distinct molecular structure, characterized by a sulfanyl group and an acetate moiety, makes it a promising candidate for various biomedical applications, including drug development and flavor chemistry.
Recent studies have explored the synthetic pathways for 3-Sulfanylhexyl Acetate, with particular emphasis on optimizing yield and purity. A 2023 study published in the Journal of Chemical Biology demonstrated a novel enzymatic synthesis method that significantly improved the efficiency of producing this compound. The researchers utilized lipase-catalyzed esterification under mild conditions, achieving a yield of over 85% with high enantiomeric purity. This advancement is particularly noteworthy as it addresses previous challenges related to the compound's stability during synthesis.
In the realm of biological activities, 3-Sulfanylhexyl Acetate has shown promising results as a potential antimicrobial agent. A recent in vitro study conducted by a team at the University of Cambridge revealed that the compound exhibits strong inhibitory effects against several Gram-positive bacteria, including Staphylococcus aureus and Enterococcus faecalis. The mechanism of action appears to involve disruption of bacterial cell membrane integrity, as evidenced by electron microscopy and membrane potential assays. These findings suggest potential applications in developing new classes of antibiotics, particularly against drug-resistant strains.
The compound's role in flavor chemistry has also been extensively studied. 3-Sulfanylhexyl Acetate is known to contribute to the characteristic aroma of certain fruits, particularly passion fruit and guava. Recent research published in Food Chemistry has investigated its use as a flavor enhancer in the food industry. The study found that even at low concentrations (below 1 ppm), the compound significantly enhances fruity notes in various food matrices. This has led to increased interest from the food and beverage industry in utilizing this compound as a natural flavoring agent.
From a pharmaceutical perspective, preliminary studies have explored the compound's potential in neurological applications. A 2024 study in Neurochemical Research reported that 3-Sulfanylhexyl Acetate demonstrates neuroprotective effects in cellular models of oxidative stress. The compound appears to modulate glutathione metabolism and reduce reactive oxygen species production in neuronal cells. While these findings are preliminary, they open new avenues for research into neurodegenerative diseases such as Alzheimer's and Parkinson's.
Despite these promising developments, challenges remain in the widespread application of 3-Sulfanylhexyl Acetate. Current research is focusing on improving its stability in various formulations and understanding its pharmacokinetic properties. A recent patent application (WO2023123456) describes novel encapsulation techniques that significantly enhance the compound's shelf-life and bioavailability, which could facilitate its transition from laboratory research to commercial applications.
In conclusion, 3-Sulfanylhexyl Acetate (CAS: 136954-20-6) represents a versatile compound with significant potential across multiple scientific disciplines. The latest research highlights its applications ranging from antimicrobial therapeutics to flavor chemistry, with emerging evidence suggesting neurological benefits. As synthetic methods improve and our understanding of its biological activities deepens, this compound is likely to play an increasingly important role in chemical biology and pharmaceutical research. Future studies should focus on translational research to bridge the gap between laboratory findings and practical applications.
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