1,3-Diazocane-2-thione

Base Information

• Chemical Name: 1,3-Diazocane-2-thione
• CAS No.: 5269-85-2
• Molecular Formula: C6H12N2S
• Molecular Weight: 144.241
• DSSTox Substance ID: DTXSID60418703
• Mol file: 5269-85-2.mol

Synonyms:1,3-Diazocane-2-thione;5269-85-2;hexahydro-1,3-diazocine-2(1H)-thione;1,3-Diazacyclooctane-2-thione;1,3-Diazocane-2-thione #;SCHEMBL8961691;DTXSID60418703;AKOS006379739;hexahydro-1,3-diazocin-2(1H)-thione

Chemical Property of 1,3-Diazocane-2-thione

Chemical Property:

• XLogP3: 0
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 144.07211956
• Heavy Atom Count: 9
• Complexity: 93.2

Purity/Quality:

95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCNC(=S)NCC1

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