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Merck

471836

1-Octanethiol

≥98.5%

Synonym(s):

n-Octyl mercaptan, Mercaptan C8, Octyl mercaptan

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About This Item

Linear Formula:
CH3(CH2)7SH
CAS Number:
Molecular Weight:
146.29
UNSPSC Code:
12352103
NACRES:
NA.23
PubChem Substance ID:
EC Number:
203-918-1
Beilstein/REAXYS Number:
1733101
MDL number:
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Quality Segment

assay

≥98.5%

refractive index

n20/D 1.452 (lit.)

bp

197-200 °C (lit.)

density

0.843 g/mL at 25 °C (lit.)

SMILES string

CCCCCCCCS

InChI

1S/C8H18S/c1-2-3-4-5-6-7-8-9/h9H,2-8H2,1H3

InChI key

KZCOBXFFBQJQHH-UHFFFAOYSA-N

General description

1-Octanethiol (OT), also known as 1-mercaptooctane, is a high-reactivity linear alkanethiol optimized for the formation of highly ordered Self-Assembled Monolayers (SAMs) on noble metals and semiconductors.
The alkyl chain provides a balance of sufficient hydrophobic shielding to protect underlying circuits from moisture while remaining thin enough to allow for efficient tunneling-based electron transport, a key requirement for molecular electronics.
Due to its low vapor pressure and precise chemical structure, this grade is preferred for cleanroom processes involving vacuum deposition or liquid-phase assembly on micro-electrode arrays. Its ability to create reproducible, uniform molecular layers makes it a standard for fine-tuning surface wetting and adhesion properties in nanofabrication.
Refined to a ≥ 98.5% high-purity specification, this grade ensures the elimination of trace impurities that could lead to lattice defects in the SAM, providing the consistency necessary for high-performance biosensors and nanoelectronic components.

Application

As a versatile linear alkanethiol, 1-Octanethiol is a foundational reagent for creating high-density molecular interfaces in sensing and organic electronic devices.
Nanoelectronic Electrode Engineering: Extensively used to improve charge injection in Thin-Film Transistors (TFTs). By forming a Self-Assembled Monolayer (SAM) on gold source-drain electrodes, it tunes the metal work function and reduces contact resistance, which is critical for bottom-contact device architectures.
Single-Molecule Electronics: Serves as a benchmark molecule for studying electron transport at the nanometer scale. It is utilized to construct single-molecule switches and transistors where conductance can be mechanically or electrically gated.
Precision Biosensing Platforms: Functions as a stabilizing and orienting interphase on gold surfaces for enzyme immobilization (e.g., glucose oxidase). Its hydrophobic chain facilitates the creation of robust "enzyme electrodes" used in point-of-care medical diagnostics.
Quantum Dot & Photovoltaic Enhancement: Acts as a sulfur precursor and ligand for CdSe/CdS quantum dots, improving the power efficiency of nanorod-sensitized solar cells by enhancing electron extraction at the interface.
Nanomaterial Surface Passivation: Used to stabilize copper and gold nanoparticles in colloidal dispersions, preventing oxidation and allowing for their integration into printable conductive inks and optical sensors.

Legal Information

Product of Arkema Inc.


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pictograms

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Warning

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 1 - Skin Sens. 1 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk

WGK 3

flash_point_f

154.4 °F - closed cup

flash_point_c

68 °C - closed cup

ppe

Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter


Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

Class II Designated Chemical Substances

prtr

Group 4: Flammable liquids + Type 2 petroleums + Hazardous rank III + Water insoluble liquid

fsl

Substances Subject to be Indicated Names

ishl_indicated

Substances Subject to be Notified Names

ishl_notified



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Influence of alkanethiols on fluorescence blinking of InP@ ZnS colloidal quantum dots.
Gak VY, et al.
High Energy Chemistry, 51(2), 118-121 (2017)
Integration of CdSe/CdSe x Te 1- x type-II heterojunction nanorods into hierarchically porous TiO 2 electrode for efficient solar energy conversion.
Lee S, et al.
Scientific Reports, 5(2), 17472-17472 (2015)
Takane Imaoka et al.
Nature communications, 8(1), 688-688 (2017-09-28)
Subnanometer noble metal clusters have enormous potential, mainly for catalytic applications. Because a difference of only one atom may cause significant changes in their reactivity, a preparation method with atomic-level precision is essential. Although such a precision with enough scalability