2,4-Dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-3H-1,2,4-triazol-3-one

Base Information

• Chemical Name: 2,4-Dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-3H-1,2,4-triazol-3-one
• CAS No.: 160455-70-9
• Molecular Formula: C11H17 N3 O3
• Molecular Weight: 239.27
• DSSTox Substance ID: DTXSID20936296
• Nikkaji Number: J543.904C
• Mol file: 160455-70-9.mol

Synonyms:160455-70-9;2,4-Dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-3H-1,2,4-triazol-3-one;2,4-bis(oxiran-2-ylmethyl)-5-propan-2-yl-1,2,4-triazol-3-one;3H-1,2,4-Triazol-3-one, 2,4-dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-;DTXSID20936296;NCUJZPXJVIWNMT-UHFFFAOYSA-N;LS-156485;1,4-Diglycidyl-3-isopropyl-1H-1,2,4-triazol-5(4H)-one;2,4-Bis[(oxiran-2-yl)methyl]-5-(propan-2-yl)-2,4-dihydro-3H-1,2,4-triazol-3-one

Chemical Property of 2,4-Dihydro-2,4-bis(oxiranylmethyl)-5-(1-methylethyl)-3H-1,2,4-triazol-3-one

Chemical Property:

• Vapor Pressure: 9.45E-05mmHg at 25°C
• Boiling Point: 339°C at 760 mmHg
• PKA: 5.59±0.20(Predicted)
• Flash Point: 158.8°C
• PSA: 64.88000
• Density: 1.5g/cm³
• LogP: -0.03420
• XLogP3: 0
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 239.12699141
• Heavy Atom Count: 17
• Complexity: 369

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)C1=NN(C(=O)N1CC2CO2)CC3CO3