2-Hydroxy-2,4,6-cycloheptatriene-1-thione

Base Information

• Chemical Name: 2-Hydroxy-2,4,6-cycloheptatriene-1-thione
• CAS No.: 1073-38-7
• Molecular Formula: C7H6 O S
• Molecular Weight: 138.19
• DSSTox Substance ID: DTXSID90901491
• Nikkaji Number: J1.398.350J,J1.732.038F
• Wikidata: Q107886298
• Mol file: 1073-38-7.mol

Synonyms:2-Sulfanylcyclohepta-2,4,6-trien-1-one;1073-38-7;2-Hydroxy-2,4,6-cycloheptatriene-1-thione;NoName_615;SCHEMBL11546968;SCHEMBL14016542;DTXSID90901491;DNBQDZRBEGFUEA-UHFFFAOYSA-N;2-mercapto-2,4,6-cycloheptatrien-1-one;EN300-322346

Chemical Property of 2-Hydroxy-2,4,6-cycloheptatriene-1-thione

Chemical Property:

• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 138.01393598
• Heavy Atom Count: 9
• Complexity: 211

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=O)C=C1)S

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