3-(2,2-Difluoroethylthio)-benzeneboronic acid

Base Information

• Chemical Name: 3-(2,2-Difluoroethylthio)-benzeneboronic acid
• CAS No.: 915402-02-7
• Molecular Formula: C8H9BF2O2S
• Molecular Weight: 218.03
• DSSTox Substance ID: DTXSID90590223
• Wikidata: Q82483942
• Mol file: 915402-02-7.mol

Synonyms:915402-02-7;3-(2,2-DIFLUOROETHYLTHIO)-BENZENEBORONIC ACID;(3-((2,2-Difluoroethyl)thio)phenyl)boronic acid;3-(2,2-Difluoroethyl thio)phenylboronic acid;{3-[(2,2-Difluoroethyl)sulfanyl]phenyl}boronic acid;starbld0019072;SCHEMBL15330762;DTXSID90590223

Chemical Property of 3-(2,2-Difluoroethylthio)-benzeneboronic acid

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 4
• Exact Mass: 218.0384372
• Heavy Atom Count: 14
• Complexity: 171

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: B(C1=CC(=CC=C1)SCC(F)F)(O)O