2-(Hexylthio)-3-methylpyrazine

Base Information

• Chemical Name: 2-(Hexylthio)-3-methylpyrazine
• CAS No.: 73972-65-3
• Molecular Formula: C11H18N2S
• Molecular Weight: 210.339
• NSC Number: 222766
• UNII: O64TNP0SB6
• DSSTox Substance ID: DTXSID20224721
• Nikkaji Number: J113.402G
• Wikidata: Q83103399
• Mol file: 73972-65-3.mol

Synonyms:2-(Hexylthio)-3-methylpyrazine;Pyrazine, 2-(hexylthio)-3-methyl-;73972-65-3;O64TNP0SB6;NSC-222766;NSC 222766;NSC222766;UNII-O64TNP0SB6;SCHEMBL22067176;DTXSID20224721;2-hexylsulfanyl-3-methyl-pyrazine;A839003

Chemical Property of 2-(Hexylthio)-3-methylpyrazine

Chemical Property:

• Vapor Pressure: 0.00186mmHg at 25°C
• Boiling Point: 301.6°Cat760mmHg
• PKA: 0.80±0.10(Predicted)
• Flash Point: 136.2°C
• PSA: 51.08000
• Density: 1.02g/cm³
• LogP: 3.45740
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 210.11906976
• Heavy Atom Count: 14
• Complexity: 141

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCSC1=NC=CN=C1C

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