2-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(1-butoxy-1-oxopropan-2-yl)oxyiminoacetic acid

Base Information

• Chemical Name: 2-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(1-butoxy-1-oxopropan-2-yl)oxyiminoacetic acid
• CAS No.: 76028-96-1
• Molecular Formula: C12H18N4O5S
• Molecular Weight: 330.36
• European Community (EC) Number: 616-285-5
• Mol file: 76028-96-1.mol

Synonyms:76028-96-1;2-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(((1-butoxy-1-oxopropan-2-yl)oxy)imino)acetic acid;SCHEMBL10848342;FT-0774692;(2E)-2-(5-amino-1,2,4-thiadiazol-3-yl)-2-(1-butoxy-1-oxopropan-2-yl)oxyiminoacetic acid

Chemical Property of 2-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(1-butoxy-1-oxopropan-2-yl)oxyiminoacetic acid

Chemical Property:

• Boiling Point: 487.8±47.0 °C(Predicted)
• PKA: 2.13±0.41(Predicted)
• Density: 1.41±0.1 g/cm3(Predicted)
• Storage Temp.: 2-8°C
• XLogP3: 2.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 9
• Exact Mass: 316.08414080
• Heavy Atom Count: 21
• Complexity: 406

Purity/Quality:

99.9% ^*data from raw suppliers

2-(5-Amino-1,2,4-thiadiazol-3-yl)-2-(((1-butoxy-1-oxopropan-2-yl)oxy)imino)aceticacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

Useful:

• Canonical SMILES: CCCCOC(=O)C(C)ON=C(C1=NSC(=N1)N)C(=O)O