4-Hydroxy-1lambda4-thian-1-one

Base Information

• Chemical Name: 4-Hydroxy-1lambda4-thian-1-one
• CAS No.: 89211-29-0
• Molecular Formula: C5H10O2S
• European Community (EC) Number: 840-171-6

Synonyms:4-hydroxy-1lambda4-thian-1-one;89211-29-0;1-oxothian-4-ol;4-hydroxytetrahydro-2H-thiopyran 1-oxide;4-hydroxy-1|E?-thian-1-one;4-hydroxy-1lambda-thian-1-one;SCHEMBL10816892;SCHEMBL10816895;AKOS010826742;tetrahydro-2H-thiopyran-4-ol 1-oxide;2H-Thiopyran-4-ol, tetrahydro-, 1-oxide;DB-377439;CS-0159275;EN300-127960

Chemical Property of 4-Hydroxy-1lambda4-thian-1-one

Chemical Property:

• XLogP3: -0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 134.04015073
• Heavy Atom Count: 8
• Complexity: 92.6

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CS(=O)CCC1O

Technology Process of 4-Hydroxy-1lambda4-thian-1-one

There total 1 articles about 4-Hydroxy-1lambda4-thian-1-one 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:

tetrahydrothiopyran-4-ol (29683-23-6) → C5H10O2S (881025-65-6,89211-29-0) + 4-hydroxytetrahydro-2H-thiopyrane 1,1-dioxide (194152-05-1)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; In chloroform-d1;

DOI:10.1002/mrc.2658

Reference yield:

C5H10O2S (881025-65-6,89211-29-0) → C16H25OS(1+)*C13H17F2O6S(1-)

Guidance literature:

Multi-step reaction with 3 steps

1.1: sodium hydride / tetrahydrofuran / 0.5 h / 23 °C

1.2: 4 h / 23 °C

2.1: lithium aluminium tetrahydride / tetrahydrofuran / 12 h / 23 °C

3.1: copper diacetate / chloroform / 2 h / 60 °C / Reflux

With lithium aluminium tetrahydride; copper diacetate; sodium hydride; In tetrahydrofuran; chloroform;

upstream raw materials:

tetrahydrothiopyran-4-ol

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