[(2S,3S)-3-Azido-4-oxoazetidin-2-yl]methyl 4-methylbenzene-1-sulfonate

Base Information

• Chemical Name: [(2S,3S)-3-Azido-4-oxoazetidin-2-yl]methyl 4-methylbenzene-1-sulfonate
• CAS No.: 61964-95-2
• Molecular Formula: C11H12N4O4S
• DSSTox Substance ID: DTXSID10707452
• Wikidata: Q82641263
• Mol file: 61964-95-2.mol

Synonyms:61964-95-2;DTXSID10707452;[(2S,3S)-3-Azido-4-oxoazetidin-2-yl]methyl 4-methylbenzene-1-sulfonate

Chemical Property of [(2S,3S)-3-Azido-4-oxoazetidin-2-yl]methyl 4-methylbenzene-1-sulfonate

Chemical Property:

• XLogP3: 1.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 296.05792605
• Heavy Atom Count: 20
• Complexity: 515

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)OCC2C(C(=O)N2)N=[N+]=[N-]
• Isomeric SMILES: CC1=CC=C(C=C1)S(=O)(=O)OC[C@@H]2[C@@H](C(=O)N2)N=[N+]=[N-]