S-(5-(Butylthio)-1,3,4-thiadiazol-2-yl) O-ethyl thiocarbonate

Base Information

• Chemical Name: S-(5-(Butylthio)-1,3,4-thiadiazol-2-yl) O-ethyl thiocarbonate
• CAS No.: 2178-97-4
• Molecular Formula: C9H14 N2 O2 S3
• Molecular Weight: 278.41466
• Hs Code.: 2934999090
• European Community (EC) Number: 218-544-4
• DSSTox Substance ID: DTXSID30176181
• Nikkaji Number: J299.146B
• Mol file: 2178-97-4.mol

Synonyms:2178-97-4;ethyl (5-butylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanylformate;S-(5-(Butylthio)-1,3,4-thiadiazol-2-yl) O-ethyl thiocarbonate;EINECS 218-544-4;DTXSID30176181;Thiocarbonic acid S-[5-(butylthio)-1,3,4-thiadiazol-2-yl]O-ethyl ester

Chemical Property of S-(5-(Butylthio)-1,3,4-thiadiazol-2-yl) O-ethyl thiocarbonate

Chemical Property:

• Vapor Pressure: 1.19E-06mmHg at 25°C
• Boiling Point: 401.3°Cat760mmHg
• Flash Point: 196.5°C
• PSA: 130.92000
• Density: 1.31g/cm³
• LogP: 3.67890
• XLogP3: 3.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 8
• Exact Mass: 278.02174121
• Heavy Atom Count: 16
• Complexity: 219

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCSC1=NN=C(S1)SC(=O)OCC

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