3-Pyridinecarbodithioic acid, methyl ester

Base Information

• Chemical Name: 3-Pyridinecarbodithioic acid, methyl ester
• CAS No.: 79639-82-0
• Molecular Formula: C7H7NS2
• Molecular Weight: 169.271
• DSSTox Substance ID: DTXSID70471622
• Nikkaji Number: J1.011.127G
• Wikidata: Q82300203

Synonyms:3-Pyridinecarbodithioic acid, methyl ester;79639-82-0;methyl pyridine-3-carbodithioate;methyl 3-pyridinecarbodithioate;methylpyridine-3-carbodithioate;DTXSID70471622;SKFLZKSHPQZTCO-UHFFFAOYSA-N

Chemical Property of 3-Pyridinecarbodithioic acid, methyl ester

Chemical Property:

• XLogP3: 2.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 169.00199157
• Heavy Atom Count: 10
• Complexity: 125

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CSC(=S)C1=CN=CC=C1

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