4-Amino-6-tert-butyl-3,4-dihydro-3-mercapto-1,2,4-triazin-5(2H)-one

Base Information

• Chemical Name: 4-Amino-6-tert-butyl-3,4-dihydro-3-mercapto-1,2,4-triazin-5(2H)-one
• CAS No.: 59742-87-9
• Molecular Formula: C7H14 N4 O S
• Molecular Weight: 202.27726
• European Community (EC) Number: 261-906-1
• DSSTox Substance ID: DTXSID30975156
• Nikkaji Number: J298.225K
• Mol file: 59742-87-9.mol

Synonyms:59742-87-9;EINECS 261-906-1;4-Amino-6-tert-butyl-3,4-dihydro-3-mercapto-1,2,4-triazin-5(2H)-one;4-amino-6-tert-butyl-3-sulfanyl-3,4-dihydro-1,2,4-triazin-5(2h)-one;DTXSID30975156;C7-H14-N4-O-S;4-Amino-6-(1,1-dimethylethyl)-3,4-dihydro-3-mercapto-1,2,4-triazin-5(2H)-one

Chemical Property of 4-Amino-6-tert-butyl-3,4-dihydro-3-mercapto-1,2,4-triazin-5(2H)-one

Chemical Property:

• Vapor Pressure: 0.000585mmHg at 25°C
• Boiling Point: 310.8°C at 760 mmHg
• Flash Point: 141.8°C
• PSA: 109.52000
• Density: 1.41g/cm³
• LogP: 0.31000
• XLogP3: 1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 202.08883226
• Heavy Atom Count: 13
• Complexity: 258

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

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

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