Ethyl 5-amino-2H-triazole-4-carboxylate

Base Information

• Chemical Name: Ethyl 5-amino-2H-triazole-4-carboxylate
• CAS No.: 61336-12-7
• Molecular Formula: C5H8N4O2
• Molecular Weight: 156.14
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID20423535
• Nikkaji Number: J480.655G
• Wikidata: Q82235773
• Mol file: 61336-12-7.mol

Synonyms:61336-12-7;Ethyl 5-amino-2H-triazole-4-carboxylate;ethyl 5-amino-1H-1,2,3-triazole-4-carboxylate;SCHEMBL11368014;DTXSID20423535;1H-1,2,3-Triazole-4-carboxylic acid, 5-amino-, ethyl ester;MFCD18975607;SY294496;Ethyl 5-Amino-1,2,3-triazole-4-carboxylate;Ethyl5-amino-2H-1,2,3-triazole-4-carboxylate;Ethyl 5-amino-2H-1,2,3-triazole-4-carboxylate;5-Amino-1H-1,2,3-triazole-4-carboxylic acid ethyl ester

Chemical Property of Ethyl 5-amino-2H-triazole-4-carboxylate

Chemical Property:

• Boiling Point: 356.9±22.0 °C(Predicted)
• PKA: 8.08±0.70(Predicted)
• PSA: 93.89000
• Density: 1.408±0.06 g/cm3(Predicted)
• LogP: 0.14480
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 156.06472551
• Heavy Atom Count: 11
• Complexity: 151

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C1=NNN=C1N