1,2,5-Oxadiazole-3-carboxamide, 4-(hydroxymethyl)-, 2-oxide (9CI)

Base Information

• Chemical Name: 1,2,5-Oxadiazole-3-carboxamide, 4-(hydroxymethyl)-, 2-oxide (9CI)
• CAS No.: 158590-73-9
• Molecular Formula: C₄H₅N₃O₄
• Molecular Weight: 159.101
• Nikkaji Number: J660.111A
• ChEMBL ID: CHEMBL206100
• Mol file: 158590-73-9.mol

Synonyms:4-hydroxynethyl-furoxan-3-carboxamide;CAS 1609;CAS-1609

Chemical Property of 1,2,5-Oxadiazole-3-carboxamide, 4-(hydroxymethyl)-, 2-oxide (9CI)

Chemical Property:

• Boiling Point: 463.698 °C at 760 mmHg
• PKA: 11.71±0.10(Predicted)
• Flash Point: 234.236 °C
• PSA: 115.80000
• Density: 2.015 g/cm³
• LogP: -0.42150
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 159.02800565
• Heavy Atom Count: 11
• Complexity: 163

Purity/Quality:

99% ^*data from raw suppliers

1,2,5-OXADIAZOLE-3-CARBOXAMIDE, 4-(HYDROXYMETHYL)-, 2-OXIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(C1=NO[N+](=C1C(=O)N)[O-])O