1-Octanethiol CAS 111-88-6

1-Octanethiol CAS 111-88-6
1-Octanethiol CAS 111-88-6

Name: 1-Octanethiol

CAS: 111-88-6

Purity: 99%min

MOQ: 1KG

Directory Guidance on 1-Octanethiol

Chemical Structure

1-Octanethiol CAS 111-88-6

Basic Info:

CAS No:111-88-6
Name:1-Octanethiol
EINECS:203-918-1
Formula:C8H18S
Weight:146.29
Other Names:1-Mercaptooctane
Type:Chemical reagents
Shelf Life:3 years
Brand Name:Look Chem
Place of Origin:Shandong, China

Product Introduction:

1-Octanethiol is a standard straight-chain alkyl thiol, with the molecular formula simply denoted as C8H17SH. It usually appears in the laboratory as a colorless or pale yellow liquid.

From a molecular structure perspective, it resembles an eight-carbon tail connected to an active thiol group (-SH). This structure enables it to thrive in organic phases while also possessing a strong nucleophilic attack capability. On industrial production lines, it is a versatile player, being present in everything from the modification of polymer materials to the synthesis of pharmaceutical intermediates.

Nature and Specifications:

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1-Octanethiol Uses:

In the organic synthesis laboratory, 1-Octanethiol is simply the “model worker” of sulfhydration reactions. Its thiol group is particularly reactive. In reactions like Michael addition, it can always precisely move towards alkenes, generating various useful sulfide compounds. Many synthetic laboratory technicians like to use it because its carbon chain length is just right – the eight carbon tails make it particularly soluble in organic solvents and less likely to have phase separation problems during reactions. Nowadays, in the synthetic routes of many complex drug molecules, it is often seen as the preferred reagent for introducing sulfur atoms. For instance, when dealing with chiral compounds, 1-Octanethiol can maintain stereoselectivity, which is particularly important for the pharmaceutical industry.

When it comes to the field of pharmaceutical research and development, 1-Octanethiol has become even more elaborate. Its molecular structure is particularly suitable for making “molecular glue”, which can connect drug molecules with targeted groups. In the currently very popular ADC drugs (antibody-drug conjugates), its derivatives are often used to link antibodies and toxin molecules. Even better, its long carbon chain can help drugs penetrate cell membranes. After being modified by it, the bioavailability of some poorly soluble drugs can be significantly improved. Researchers engaged in drug metabolism have also found that compounds modified with 1-Octanethiol are more stable in the body, which provides a new idea for the design of long-acting drugs.

In the field of agrochemicals, 1-Octanethiol is a smart “deliveryman”. Nowadays, pesticides emphasize precise application. 1-Octanethiol can help create a slow-release system – its sulfur atoms can capture pesticide molecules and will not be immediately washed away by rain but will be released slowly. Even smarter is that its thiol group can form hydrogen bonds with the waxy layer on the surface of plant leaves, making the pesticide seem to “stick” to the leaf surface. Recent studies have also found that seeds treated with it have a higher germination rate, possibly because sulfur is involved in certain metabolic pathways that promote growth.

Materials scientists have even taken 1-Octanethiol-mercaptan to new heights. Nowadays, the most popular surface modification of nanomaterials has almost become its exclusive stage. For instance, when preparing gold nanorods, the addition of 1-Octanethiol can control the aspect ratio. This discovery has excited many research groups engaged in photothermal therapy. In the field of polymer materials, it is like “molecular sewing thread”, capable of bridging and cross-linking between polymer chains. A team tried adding it to a rubber formula, and as a result, the anti-aging performance of the material was directly improved to a new level.

Recently, the ingenious uses of 1-Octanethiol have also been discovered in the field of daily chemical industry. Although the pure flavor is touching, when diluted to a concentration of one part per million, it will instead produce a unique meaty aroma. Nowadays, some high-end flavoring companies use it to blend food flavorings for grilled meat flavors. However, this application should be particularly cautious, as food safety standards cannot be taken lightly. In terms of personal care products, its derivatives can improve the stability of the formula, especially in products containing metal ions, where it can play a “stabilizing” role.

The energy sector even regards it as a treasure. The biggest challenge for lithium-sulfur batteries is the shuttle effect of polysulfides, and the derivatives of 1-Octanethiol can lock polysulfides like a “cage”. A team has conducted experiments and found that after adding it, the battery’s cycle life was directly doubled. The field of fuel cells is also exploring the use of it to modify the surface of catalysts. Preliminary results show that it can reduce the amount of precious metals used. However, this direction is still in the laboratory stage. Industrialization needs to overcome cost issues, but the prospects are indeed promising.

The Advantages of 1-Octanethiol

The most commendable feature of 1-Octanethiol is its “flexible and adaptable” reaction personality. The thiol group is particularly interesting. It can react under mild conditions without being so active that it is difficult to control. Just as experienced synthetic personnel put it, reacting with 1-Octanethiol is like “simmering over low heat” – good results can be achieved without intense conditions. Its long carbon chain structure is also a brilliant trick, which not only ensures its solubility in the organic phase but also prevents it from crystallizing and precipitating as easily as longer thiols. Researchers who have conducted parallel experiments all know that compared with short-chain mercaptans, 1-Octanethiol has a moderate odor volatility and is more acceptable in a laboratory environment.

When it comes to practicality, 1-Octanethiol is simply made for industrial production. Its raw material, octanol, is a bulk chemical, and its production process is as mature as a “textbook level”, which means stable prices and abundant supply. One of the things the factory likes most about it is that the post-treatment after the reaction is particularly simple – in most cases, just a few washes with water can yield a product of sufficient purity. Even during large-scale production, there are rarely safety issues such as unexpected heat release. This predictability saves the engineering department a lot of trouble. Quality control personnel also appreciate its good batch stability, unlike some natural products whose properties vary from batch to batch.

In terms of safety performance, 1-Octanethiolcan be said to be a “good student”. Although the MSDS indicates that it is irritating, its boiling point is relatively high and it is not easy to volatilize, which greatly reduces the risk of inhalation. Environmental assessment data also shows that it will naturally degrade into harmless sulfates in the environment and will not remain for a long time like some halogenated compounds. An EHS specialist made an analogy: 1-Octanethiol is like a well-trained working dog – it needs to be operated in a standardized manner, but it won’t bite for no reason.

In terms of economic benefits, 1-Octanethiol has performed particularly outstandingly. Its “cost performance” is particularly prominent – it not only has the functions of specialty chemicals but also maintains the price of bulk chemicals. The purchasing managers have calculated that using it can save a lot of special storage costs, and a general chemical warehouse can meet the storage requirements. What’s more cost-effective is that it has a wide range of applications. Purchasing a batch of goods can support different R&D projects and reduce capital occupation.

Its multi-functionality is even more its trump card. The same 1-Octanethiol-captan molecule can be used as a surface modifier in the materials group, as a prodrug in the pharmacy group, and as an additive in the agrochemical group. This “versatile” characteristic has greatly enhanced the efficiency of research and development. Its derivative library is also particularly rich, and it can easily derive dozens of useful compounds.

Related References:

  1. Chemicalbook
  2. Wikipedia

1-Octanethiol Manufacturer & Supplier

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3. Route of synthesis (ROS)

4. Method of Aanlysis (MOA)

5. Nuclear Magnetic Resonance (NMR)

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