4-Methoxy-2-methylthiophenol

Base Information

• Chemical Name: 4-Methoxy-2-methylthiophenol
• CAS No.: 698-81-7
• Molecular Formula: C8H10OS
• Molecular Weight: 154.233
• Hs Code.: 2930909090
• European Community (EC) Number: 675-567-6
• DSSTox Substance ID: DTXSID00374859
• Wikidata: Q82163432
• Mol file: 698-81-7.mol

Synonyms:4-Methoxy-2-methylthiophenol;698-81-7;4-methoxy-2-methylbenzenethiol;4-methoxy-2-methylbenzene-1-thiol;4-methoxy-2-methyl thiophenol;4-methoxy-2-methyl-benzenethiol;4-methoxythiocresol;4-methoxythiocresole;SCHEMBL2911817;DTXSID00374859;WXKKTBSADLTBPS-UHFFFAOYSA-N;AKOS009266201;CS-0280608;FT-0716223;EN300-1262500;A836682

Chemical Property of 4-Methoxy-2-methylthiophenol

Chemical Property:

• Vapor Pressure: 0.0383mmHg at 25°C
• Boiling Point: 248.4°C at 760 mmHg
• Flash Point: 104°C
• PSA: 48.03000
• Density: 1.083g/cm³
• LogP: 2.29230
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 154.04523611
• Heavy Atom Count: 10
• Complexity: 105

Purity/Quality:

98%Min ^*data from raw suppliers

4-METHOXY-2-METHYLTHIOPHENOL ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)OC)S

Technology Process of 4-Methoxy-2-methylthiophenol

There total 2 articles about 4-Methoxy-2-methylthiophenol which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ 5-methoxy-2-mercapto-toluene (698-81-7)

Guidance literature:

With hydrogenchloride; tin; zuletzt auf dem Dampfbad;

DOI:10.1039/jr9330001375

Reference yield:

→ 5-methoxy-2-mercapto-toluene (698-81-7)

Guidance literature:

/BRN= 330868/, Zn, H2SO4, in ice water;

Reference yield:

5-methoxy-2-mercapto-toluene (698-81-7) → 4-(methylthio)-m-cresol (3120-74-9)

Guidance literature:

Multi-step reaction with 2 steps

1: aqueous NaOH

2: glacial acetic acid; aqueous HBr / 120 - 130 °C

With sodium hydroxide; hydrogen bromide; acetic acid;

DOI:10.1021/ja01326a079

Downstream raw materials:

4-methoxy-2-methyl-1-methylsulfanylbenzene

[2,5-Dichloro-4-(4-methoxy-2-methyl-phenylsulfanylthiocarbonylamino)-phenyl]-dithiocarbamic acid 4-methoxy-2-methyl-phenyl ester

4-(methylthio)-m-cresol

4-ethylsulfanyl-3-methyl-phenol

Refernces

• 1、 -. "HEXAHYDRO-(1)-BENZO-(PYRANO AND THIOPYRANO) (4,3-c)PYRIDINES, USEFUL AS SEROTIN-2 BLOCKING AGENTS". . . Retrieved 2008/06/13.