[3,5-bis(bromanyl)-2-propylsulfanyl-phenyl]boronic acid

Systemtic Name: [3,5-bis(bromanyl)-2-propylsulfanyl-phenyl]boronic acid Openeye Name: (3,5-dibromo-2-propylsulfanyl-phenyl)boronic acid CAS Name: [3,5-dibromo-2-(propylthio)phenyl]boronic acid IUPAC Name: (3,5-dibromo-2-propylsulfanylphenyl)boronic acid Traditional Name: [3,5-dibromo-2-(propylthio)phenyl]boronic acid Formula: C9H11BBr2O2S MolecularWeight: 353.86644

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC(=CC(=C1SCCC)Br)Br)(O)O

Isomeric SMILES

B(C1=CC(=CC(=C1SCCC)Br)Br)(O)O

InChI

InChI=1S/C9H11BBr2O2S/c1-2-3-15-9-7(10(13)14)4-6(11)5-8(9)12/h4-5,13-14H,2-3H2,1H3