5-Butyl-2-(N-tert-butylaminosulfonyl)thiophene-3-boronic acid

Base Information

• Chemical Name: 5-Butyl-2-(N-tert-butylaminosulfonyl)thiophene-3-boronic acid
• CAS No.: 163520-15-8
• Molecular Formula: C12H22BNO4S2
• Molecular Weight: 319.24800
• DSSTox Substance ID: DTXSID40475415
• Wikidata: Q82305936
• Mol file: 163520-15-8.mol

Synonyms:163520-15-8;[5-butyl-2-(tert-butylsulfamoyl)thiophen-3-yl]boronic Acid;(5-Butyl-2-(N-(tert-butyl)sulfamoyl)thiophen-3-yl)boronic acid;5-Butyl-2-(N-tert-butylaminosulfonyl)thiophene-3-boronic acid;starbld0019292;SCHEMBL710923;DTXSID40475415;QRYOHDBVTYRLGU-UHFFFAOYSA-N

Chemical Property of 5-Butyl-2-(N-tert-butylaminosulfonyl)thiophene-3-boronic acid

Chemical Property:

• Boiling Point: 497.6±55.0 °C(Predicted)
• PSA: 123.25000
• Density: 1.25±0.1 g/cm3(Predicted)
• LogP: 2.31900
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 319.1083307
• Heavy Atom Count: 20
• Complexity: 403

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: B(C1=C(SC(=C1)CCCC)S(=O)(=O)NC(C)(C)C)(O)O

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