3-[[(4-Methylphenyl)sulfonyl]methyl]-2-thiophenemethanol

Base Information

Chemical Name:3-[[(4-Methylphenyl)sulfonyl]methyl]-2-thiophenemethanol
CAS No.:99708-89-1
Molecular Formula:C₁₃H₁₄O₃S₂
Molecular Weight:282.384
Hs Code.:
DSSTox Substance ID:DTXSID501200050

Synonyms:3-[[(4-Methylphenyl)sulfonyl]methyl]-2-thiophenemethanol;DTXSID501200050;99708-89-1

Suppliers and Price of 3-[[(4-Methylphenyl)sulfonyl]methyl]-2-thiophenemethanol

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 3-[[(4-Methylphenyl)sulfonyl]methyl]-2-thiophenemethanol

Chemical Property:

XLogP3:1.8
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:282.03843665
Heavy Atom Count:18
Complexity:353

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CC1=CC=C(C=C1)S(=O)(=O)CC2=C(SC=C2)CO

Technology Process of 3-[[(4-Methylphenyl)sulfonyl]methyl]-2-thiophenemethanol

There total 5 articles about 3-[[(4-Methylphenyl)sulfonyl]methyl]-2-thiophenemethanol 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: 95.0%

: 81452-50-8
methyl 3-(tosylmethyl)thiophene-2-carboxylate

: 99708-89-1
2-(hydroxymethyl)-3-(tosylmethyl)thiophene

Guidance literature:: With lithium triethylborohydride; In tetrahydrofuran; for 4h;
DOI:10.1021/jo00352a019

Reference yield:

: 81452-54-2
methyl 3-methylthiophene-2-carboxylate

: 99708-89-1
2-(hydroxymethyl)-3-(tosylmethyl)thiophene

Guidance literature:: Multi-step reaction with 3 steps

1: 81 percent / N-bromosuccinimide (NBS), dibenzoyl peroxide / CCl₄ / 2 h / Heating

2: 74 percent / dimethylsulfoxide / 17 h

3: 95 percent / LiEt₃BH / tetrahydrofuran / 4 h

With N-Bromosuccinimide; lithium triethylborohydride; dibenzoyl peroxide; In tetrahydrofuran; tetrachloromethane; dimethyl sulfoxide;
DOI:10.1021/jo00352a019

Reference yield:

: 59961-15-8
methyl 3-(bromomethyl)thiophene-2-carboxylate

: 99708-89-1
2-(hydroxymethyl)-3-(tosylmethyl)thiophene

Guidance literature:: Multi-step reaction with 2 steps

1: 74 percent / dimethylsulfoxide / 17 h

2: 95 percent / LiEt₃BH / tetrahydrofuran / 4 h

With lithium triethylborohydride; In tetrahydrofuran; dimethyl sulfoxide;
DOI:10.1021/jo00352a019