2-(Methylsulfonamido)pyrimidine-5-boronic acid

Base Information

• Chemical Name: 2-(Methylsulfonamido)pyrimidine-5-boronic acid
• CAS No.: 1256345-71-7
• Molecular Formula: C5H8BN3O4S
• Molecular Weight: 217.01072
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID00681555
• Wikidata: Q82605634
• Mol file: 1256345-71-7.mol

Synonyms:1256345-71-7;2-(Methylsulfonamido)pyrimidine-5-boronic acid;(2-(Methylsulfonamido)pyrimidin-5-yl)boronic acid;[2-(methanesulfonamido)pyrimidin-5-yl]boronic acid;DTXSID00681555;AKOS015852599;SB60464;(2-(Methylsulfonamido)pyrimidin-5-yl)boronicacid;{2-[(Methanesulfonyl)amino]pyrimidin-5-yl}boronic acid

Chemical Property of 2-(Methylsulfonamido)pyrimidine-5-boronic acid

Chemical Property:

• Boiling Point: 519.3±60.0 °C(Predicted)
• PKA: 4.67±0.10(Predicted)
• PSA: 120.79000
• Density: 1.58±0.1 g/cm3(Predicted)
• LogP: -1.31830
• Storage Temp.: Refrigerated.
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 217.0328571
• Heavy Atom Count: 14
• Complexity: 269

Purity/Quality:

≥95% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=CN=C(N=C1)NS(=O)(=O)C)(O)O