5-Methylthiothiophen-2(5H)-one

Base Information

• Chemical Name: 5-Methylthiothiophen-2(5H)-one
• CAS No.: 7210-65-3
• Molecular Formula: C5H6OS2
• Molecular Weight: 0
• DSSTox Substance ID: DTXSID301302278
• Nikkaji Number: J103.198H
• Mol file: 7210-65-3.mol

Synonyms:7210-65-3;Crotonic acid, 4-mercapto-4-(methylthio)-, .gamma.-(thio lactone);5-Methylthiothiophen-2(5H)-one;DTXSID301302278;5-(Methylthio)-2(5H)-thiophenone;5-(Methylsulfanyl)-2(5H)-thiophenone #

Chemical Property of 5-Methylthiothiophen-2(5H)-one

Chemical Property:

• Boiling Point: 290.8±40.0 °C(Predicted)
• PSA: 67.67000
• Density: 1.30±0.1 g/cm3(Predicted)
• LogP: 1.50510
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 145.98600716
• Heavy Atom Count: 8
• Complexity: 130

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC1C=CC(=O)S1