4-Boronobenzenesulfonic acid

Base Information

• Chemical Name: 4-Boronobenzenesulfonic acid
• CAS No.: 913836-00-7
• Molecular Formula: C6H7BO5S
• Molecular Weight: 201.996
• Hs Code.: 2931900090
• European Community (EC) Number: 804-884-6
• DSSTox Substance ID: DTXSID20603572
• Wikidata: Q82501024
• Mol file: 913836-00-7.mol

Synonyms:4-Boronobenzenesulfonic acid;913836-00-7;4-(dihydroxyboranyl)benzene-1-sulfonic acid;4-(Hydroxysylphonyl)boronic acid;Benzenesulfonic acid, 4-borono- (9CI);C6H7BO5S;4-BORONOBENZENESULFONICACID;4-Sulfobenzeneboronic acid;4-Boronobenzenesulphonic acid;SCHEMBL10713994;4-Boronobenzene-1-sulfonic acid;DTXSID20603572;Benzenesulfonic acid,4-borono-(9ci);MFCD09027231;AKOS015833560;BS-24811;CS-0174710;EN300-4255993;A853406

Chemical Property of 4-Boronobenzenesulfonic acid

Chemical Property:

• Refractive Index: 1.619
• PKA: -0.72±0.50(Predicted)
• PSA: 103.21000
• Density: 1.62 g/cm³
• LogP: -0.30610
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 2
• Exact Mass: 202.0107247
• Heavy Atom Count: 13
• Complexity: 249

Purity/Quality:

97% ^*data from raw suppliers

4-Boronobenzenesulfonicacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

Useful:

• Canonical SMILES: B(C1=CC=C(C=C1)S(=O)(=O)O)(O)O