Methyl 2-(1H-tetrazol-1-yl)propanoate

Base Information

• Chemical Name: Methyl 2-(1H-tetrazol-1-yl)propanoate
• CAS No.: 103557-29-5
• Molecular Formula: C5H8 N4 O2
• Molecular Weight: 156.14
• DSSTox Substance ID: DTXSID50601945
• Mol file: 103557-29-5.mol

Synonyms:103557-29-5;methyl 2-(tetrazol-1-yl)propanoate;1H-Tetrazole-1-aceticacid,alpha-methyl-,methylester(9CI);Methyl 2-(1H-tetrazol-1-yl)propanoate;SCHEMBL10492468;DTXSID50601945;PPTXBXSPDLTXQY-UHFFFAOYSA-N;methyl 2-(1,2,3,4-1H-tetrazol-1-yl)propionate

Chemical Property of Methyl 2-(1H-tetrazol-1-yl)propanoate

Chemical Property:

• Boiling Point: 263.8±42.0 °C(Predicted)
• PKA: 0.46±0.10(Predicted)
• PSA: 69.90000
• Density: 1.40±0.1 g/cm3(Predicted)
• LogP: -0.59290
• XLogP3: 0
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 156.06472551
• Heavy Atom Count: 11
• Complexity: 151

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)OC)N1C=NN=N1