2,6-DIMETHYLTHIOPHENOL

2,6-DIMETHYLTHIOPHENOL Basic information
Description
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
2,6-DIMETHYLTHIOPHENOL Structure
2,6-DIMETHYLTHIOPHENOL Chemical Properties
Melting point -30°C (estimate)
Boiling point 122 °C50 mm Hg
density 1.038 g/mL at 25 °C
FEMA 3666 | 2,6-DIMETHYLTHIOPHENOL
refractive index n20/D 1.575
Fp 186 °F
storage temp. Inert atmosphere,Room Temperature
form liquid
pka7.03±0.50(Predicted)
color Clear
Specific Gravity1.038
Odorat 0.10 % in propylene glycol. sulfury meaty roasted phenolic metallic
Odor Typesulfurous
Sensitive Moisture Sensitive
JECFA Number530
BRN 1099405
InChIKeyQCLJODDRBGKIRW-UHFFFAOYSA-N
LogP3.15
CAS DataBase Reference118-72-9(CAS DataBase Reference)
EPA Substance Registry SystemBenzenethiol, 2,6-dimethyl- (118-72-9)
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 6.1
HazardClass IRRITANT, STENCH
HS Code 29309090
MSDS Information
ProviderLanguage
SigmaAldrich English
ACROS English
ALFA English
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 Propertiesclear colorless to light yellow liquid
Chemical Properties2,6-Dimethylthiophenol has a strong odor.
OccurrenceReported found in boiled beef
Uses2,6-Dimethylbenzenethiol was used in the synthesis of (2,6-Me2C6H3S)2Pb by reacting with Pb(OAc)2.
Taste threshold valuesMeaty, vegetative and nutty with a slight sulfuraceous nuance.
2,6-DIMETHYLTHIOPHENOL Preparation Products And Raw materials
4-METHOXY-2,3,6-TRIMETHYLBENZENESULFONYL CHLORIDE 1-MESITYLENESULFONYL-1,2,4-TRIAZOLE 2,6-DIMETHYLTHIOPHENOL 2,3,5,6-TETRAMETHYLBENZENESULFONYL CHLORIDE 2,4,6-Triisopropylbenzenesulfonyl chloride ACID BLUE 80 PENTAMETHYLBENZENESULFONYL CHLORIDE 2,4,6-TRIISOPROPYLBENZENESULFONYL HYDRAZIDE 1-(Mesitylene-2-sulfonyl)-3-nitro-1,2,4-triazole BOC-ARG(MTS)-OH Mesitylene-2-sulfonyl chloride N-Fmoc-N'-(4-methoxy-2,3,6-trimethylbenzenesulfonyl)-L-arginine 2-MESITYLENESULFONYL CHLORIDE 2,4,6-TRIMETHYLBENZENESULFONYL HYDRAZIDE N-MESITYLENESULFONYLIMIDAZOLE Ethyl O-mesitylsulfonylacetohydroxamate 1-(2,4,6-Triisopropylphenylsulfonyl)imidazole 1-[[2,4,6-Tris(isopropyl)phenyl]sulphonyl]-1H-1,2,4-triazole

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