5-amino-4,5-dihydro-3H-1,2,4-triazole-3-carboxylic Acid

Base Information

• Chemical Name: 5-amino-4,5-dihydro-3H-1,2,4-triazole-3-carboxylic Acid
• CAS No.: 401624-18-8
• Molecular Formula: C3H6 N4 O2
• Molecular Weight: 130.10534
• DSSTox Substance ID: DTXSID30409047
• Mol file: 401624-18-8.mol

Synonyms:5-amino-4,5-dihydro-3H-1,2,4-triazole-3-carboxylic Acid;401624-18-8;SCHEMBL15331674;DTXSID30409047

Chemical Property of 5-amino-4,5-dihydro-3H-1,2,4-triazole-3-carboxylic Acid

Chemical Property:

• Boiling Point: 339.5±42.0 °C(Predicted)
• PKA: 2.25±0.20(Predicted)
• PSA: 100.07000
• Density: 2.26±0.1 g/cm3(Predicted)
• LogP: -1.40490
• XLogP3: -3.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 1
• Exact Mass: 130.04907545
• Heavy Atom Count: 9
• Complexity: 156

Purity/Quality:

99%min ^*data from raw suppliers

5-AMINO-4,5-DIHYDRO-3H-1,2,4-TRIAZOLE-3-CARBOXYLIC ACID 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(NC(N=N1)N)C(=O)O