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2,6-DIMETHYLTHIOPHENOL

Basic information Description Safety Supplier Related

2,6-DIMETHYLTHIOPHENOL Basic information

Product Name:
2,6-DIMETHYLTHIOPHENOL
Synonyms:
  • Vortioxetine Impurity 44
  • O-Toluenethiol 2,6-Dimethyl benzenethiol
  • 2,6-DIMETHYLBENZENETHIOL
  • 2,6-DIMETHYLTHIOPHENOL
  • FEMA 3666
  • 2,6-dimethyl-benzenethio
  • 2 6-DIMETHYLTHIOPHENOL 95+%
  • 2,6-Dimethylbenzolthiol
CAS:
118-72-9
MF:
C8H10S
MW:
138.23
EINECS:
204-272-3
Product Categories:
  • Bioactive Small Molecules
  • Building Blocks
  • Cell Biology
  • Chemical Synthesis
  • DIG-DY
  • Organic Building Blocks
  • Sulfur Compounds
  • Thiols/Mercaptans
Mol File:
118-72-9.mol
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2,6-DIMETHYLTHIOPHENOL Chemical Properties

Melting point:
-30°C (estimate)
Boiling point:
122 °C50 mm Hg
Density 
1.038 g/mL at 25 °C
refractive index 
n20/D 1.575
FEMA 
3666 | 2,6-DIMETHYLTHIOPHENOL
Flash point:
186 °F
storage temp. 
Inert atmosphere,Room Temperature
form 
liquid
pka
7.03±0.50(Predicted)
color 
Clear
Specific Gravity
1.038
Odor
at 0.10 % in propylene glycol. sulfury meaty roasted phenolic metallic
Odor Type
sulfurous
Sensitive 
Moisture Sensitive
JECFA Number
530
BRN 
1099405
InChIKey
QCLJODDRBGKIRW-UHFFFAOYSA-N
LogP
3.15
CAS DataBase Reference
118-72-9(CAS DataBase Reference)
EPA Substance Registry System
Benzenethiol, 2,6-dimethyl- (118-72-9)
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Safety Information

Hazard Codes 
Xi
Risk Statements 
36/37/38
Safety Statements 
26-36/37/39-36-7/9
RIDADR 
UN 3334
WGK Germany 
2
TSCA 
T
HazardClass 
IRRITANT, STENCH
HazardClass 
6.1
HS Code 
29309090

MSDS

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2,6-DIMETHYLTHIOPHENOL Usage And Synthesis

Description

2,6-Dimethylbenzenethiol, also known as 2,6-dimethyl thiophenol or 2,6-xylenethiol, the molecular formula is C8H10S, which belongs to the class of organic compounds known as thiophenols. Thiophenols are compounds containing a thiophenol ring, which a phenol derivative obtained by replacing the oxygen atom from the hydroxyl group (attached to the benzene) by a sulfur atom. 2,6-Dimethylbenzenethiol is a very weakly acidic compound (based on its pKa). 2,6-Dimethylbenzenethiol is a meaty, metallic, and phenolic tasting compound.
2,6-Dimethylbenzenethiol is found in animal foods. It is present in boiled beef. It is a flavouring ingredient. 2,6-Dimethylbenzenethiol was used in the synthesis of (2,6-Me2C6H3S)2Pb by reacting with Pb(OAc)2.

Chemical Properties

clear colorless to light yellow liquid

Chemical Properties

2,6-Dimethylthiophenol has a strong odor.

Occurrence

Reported found in boiled beef

Uses

2,6-Dimethylbenzenethiol was used in the synthesis of (2,6-Me2C6H3S)2Pb by reacting with Pb(OAc)2.

Taste threshold values

Meaty, vegetative and nutty with a slight sulfuraceous nuance.

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