93002-38-1

Basic information

• Product Name: 2,2,4,6,6-pentamethylheptane-4-thiol
• Synonyms: 2,2,4,6,6-pentamethylheptane-4-thiol;4-Heptanethiol,2,2,4,6,6-pentaMethyl-;2,2,4,6,6-Pentamethyl-4-heptanethiol
• CAS NO: 93002-38-1
• Molecular Formula: C₁₂H₂₆S
• Molecular Weight: 202.39984
• EINECS: 296-714-7
• Mol File: 93002-38-1.mol
• Article Data: 0

Chemical Properties

• Boiling Point: 218.8 °C at 760 mmHg
• Flash Point: 72.5 °C
• Appearance: /
• Density: 0.84 g/cm³
• Vapor Pressure: 0.182mmHg at 25°C
• Refractive Index: 1.455
• PKA: 11.34±0.10(Predicted)
• CAS DataBase Reference: 2,2,4,6,6-pentamethylheptane-4-thiol(CAS DataBase Reference)
• NIST Chemistry Reference: 2,2,4,6,6-pentamethylheptane-4-thiol(93002-38-1)
• EPA Substance Registry System: 2,2,4,6,6-pentamethylheptane-4-thiol(93002-38-1)

Safety Data

• Hazardous Substances Data: 93002-38-1(Hazardous Substances Data)

Usage

General Description

2,2,4,6,6-pentamethylheptane-4-thiol is a chemical compound with the molecular formula C11H24S. It is a sulfurous thiol that is commonly used as a flavoring agent in the food industry due to its strong, pungent odor. It is also used as a fragrance ingredient in perfumes and personal care products. Additionally, 2,2,4,6,6-pentamethylheptane-4-thiol is utilized in the production of other chemicals and as a chemical intermediate in various industrial processes. Due to its low toxicity and stability, it is considered safe for use in these applications.

InChI:InChI=1/C12H26S/c1-10(2,3)8-12(7,13)9-11(4,5)6/h13H,8-9H2,1-7H3