1-octanethiol

CAS Number
111-88-6
EC Number
203-918-1

What is 1-octanethiol?

1-Octanethiol (CAS 111-88-6), also known commercially as n-octyl mercaptan, is a sulfur-containing organic compound used as a chain transfer agent in polymer synthesis.

Where is 1-octanethiol used?

  • Specialty chemicals: chemical intermediate
  • Pharmaceuticals: synthetic intermediate for active ingredients and sulfur-containing compounds
  • Polymer production: controls molecular weight during free-radical polymerization of acrylates, styrene, and vinyl acetate, influencing final resin mechanical properties
  • Lubricants: extreme-pressure additive packages for metalworking fluids, providing boundary lubrication under high-load conditions
  • Specialty materials: coupling agent and surface modifier for metal nanoparticles and quantum dots
  • It also serves as a functional building block in pharmaceutical and industrial processes.

Commercial specifications

  • Purity levels of 98% or higher
  • Technical grade is the most common commercial specification
  • High-purity grades for pharmaceutical and specialty materials applications
  • Certificate of analysis documentation is standard for regulated-industry procurement

Other Names (Synonyms)

n-octyl mercaptan|1-octylthiol|1-mercaptooctane|Octane-1-thiol|Octyl mercaptan|n-Octanethiol

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What are the physical properties of 1-octanethiol?

Melting Point -49.2 °C
Boiling Point 86 °C @ Press: 15 Torr
Density 0.8433 g/cm³ @ Temp: 20 °C
Flash Point 55 °F
Appearance colourless liquid
Color Clear colorless
Odor Sulfurous
Form Liquid
Water Solubility Not miscible in water.
Vapor Pressure 0.3 hPa (20 °C)
Refractive Index n 20/D 1.452(lit.)
Log P 4.21 at 20℃

How is 1-octanethiol classified and handled safely? Learn More

Warning
GHS07· Irritant GHS09· Environmental Hazard GHS08· Health Hazard

Hazard Statements

H227 Combustible liquid
H302 Harmful if swallowed
H312 Harmful in contact with skin
H315 Causes skin irritation

Precautionary Statements

P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.
P260 Do not breathe dust/fume/gas/mist/vapours/spray.
P261 Avoid breathing dust/fume/gas/mist/vapours/spray.
P264 Wash … thoroughly after handling.

Which trade and regulatory codes apply to 1-octanethiol?

HS Code 29309070
UN Number 1170
ADR Class 3
Packing Group II
Storage Class 10 - Combustible liquids
WGK (Germany) 3
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