3,5-Dimethyl-4-(methylthio)phenol

Basic Information

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CAS Number

7379-51-3

Molecular Formula

C9H12OS

Molecular Weight

168.26 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Hydrocarbons

Basic Physical Properties

Boiling Point

267.9 °C at 760 mmHg

Density

1.12

Flash Point

130.8 °C

Refractive Index

1.585

SMILES

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CC1=CC(=CC(=C1SC)C)O

InChI

InChI=1S/C9H12OS/c1-6-4-8(10)5-7(2)9(6)11-3/h4-5,10H,1-3H3

InChIKey

JGFZITGNFAVSKU-UHFFFAOYSA-N

LogP

2.7309400000000017

Topological Polar Surface Area

20.23 Å²

Hydrogen Bond Donor/Acceptor

1 / 1

Complexity

115

Synonyms & References

English

EINECS 230-947-7
W-104443
UNII-D73AE3R9ZD
3,5-Dimethyl-4-(methylthio)phenol
4-METHYLSULFANYL-3,5-DIMETHYLPHENOL
Methiocarb M03
4-Methylthio-3,5-xylenol
CHEBI:38509
4-(Methylthio)-3,5-dimethylphenol
3,5-dimethyl-4-methylsulfanyl-phenol
NS00003253
DTXSID9041497
Q27117884
AKOS006278452
4-methylsulfanyl-3,5-dimethyl-phenol
D73AE3R9ZD
3,5-dimethyl-4-methylsulfanylphenol
METHYLTHIO)-3,5-XYLENOL, 4-
SCHEMBL2790222
FT-0650246
4-(Methylthio)-3,5-xylenol
BRN 2045340
2,6-DIMETHYL-4-HYDROXYTHIOANISOLE
7379-51-3
Phenol, 3,5-dimethyl-4-(methylthio)-
A837930
EC 230-947-7
3,5-dimethyl-4-(methylsulfanyl)phenol
3,5-XYLENOL, 4-(METHYLTHIO)-
4-(methylthio)-3,5-xylenol
3,5-Dimethyl-(4-thiomethyl) Phenol

MDL Number

MFCD01707476

Customs Code

2930909090

FAQ

What regulatory guidelines apply to 3,5-Dimethyl-4-(methylthio)phenol (CAS: 7379-51-3)?

3,5-Dimethyl-4-(methylthio)phenol (CAS: 7379-51-3) falls under the GHS classification as a category 2 skin corrosion/irritation. It is subject to REACH regulations, which require manufacturers and importers to register substances with the European Chemicals Agency (ECHA) if the tonnage threshold is exceeded. Additionally, the FDA and EPA may have specific requirements for handling and disposal in the United States, particularly concerning environmental protection and worker safety.

Are there alternatives to 3,5-Dimethyl-4-(methylthio)phenol in synthesis (CAS: 7379-51-3)?

Yes, there are alternatives to 3,5-Dimethyl-4-(methylthio)phenol in synthesis. For instance, 3,5-Dimethyl-4-thioanisole can be used as a similar compound. Other alternatives include using 4-(methylthio)toluene or its isomeric forms. These alternatives offer similar functionalities but may have different reactivity and solubility properties.

What is the market or research trend for 3,5-Dimethyl-4-(methylthio)phenol (CAS: 7379-51-3)?

The market for 3,5-Dimethyl-4-(methylthio)phenol is currently stable, with growing research interest in its use as a precursor in pharmaceuticals and agrochemicals. Recent studies have explored its potential in developing novel drugs and pesticides. Pricing trends indicate a steady demand, though fluctuations may occur due to supply chain and regulatory changes. Emerging research fields are focusing on its environmental impact and safe disposal methods.

How should waste containing 3,5-Dimethyl-4-(methylthio)phenol (CAS: 7379-51-3) be handled?

Waste containing 3,5-Dimethyl-4-(methylthio)phenol should be collected in appropriate containers and stored in a well-ventilated area away from heat and sources of ignition. Proper incineration or professional waste disposal services should be utilized to ensure safe disposal. Environmental protection must be a priority, and precautions should include proper handling to avoid contamination of soil and water. Compliance with local and national waste management regulations is essential.