[4-(phenylmethylsulfanyl)phenyl]boronic acid

Systemtic Name: [4-(phenylmethylsulfanyl)phenyl]boronic acid Openeye Name: (4-benzylsulfanylphenyl)boronic acid CAS Name: [4-(phenylmethylthio)phenyl]boronic acid IUPAC Name: (4-benzylsulfanylphenyl)boronic acid Traditional Name: [4-(benzylthio)phenyl]boronic acid Formula: C13H13BO2S MolecularWeight: 244.11712

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)SCC2=CC=CC=C2)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)SCC2=CC=CC=C2)(O)O

InChI

InChI=1S/C13H13BO2S/c15-14(16)12-6-8-13(9-7-12)17-10-11-4-2-1-3-5-11/h1-9,15-16H,10H2