5,6-bis(chloranyl)-2-(4-methylsulfanylphenyl)-1,3,2-benzodioxaborole

Systemtic Name: 5,6-bis(chloranyl)-2-(4-methylsulfanylphenyl)-1,3,2-benzodioxaborole Openeye Name: 5,6-dichloro-2-(4-methylsulfanylphenyl)-1,3,2-benzodioxaborole CAS Name: 5,6-dichloro-2-[4-(methylthio)phenyl]-1,3,2-benzodioxaborole IUPAC Name: 5,6-dichloro-2-(4-methylsulfanylphenyl)-1,3,2-benzodioxaborole Traditional Name: 5,6-dichloro-2-[4-(methylthio)phenyl]-1,3,2-benzodioxaborole Formula: C13H9BCl2O2S MolecularWeight: 310.99136

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Descriptors Computed from Structure

Canonical SMILES:

B1(OC2=CC(=C(C=C2O1)Cl)Cl)C3=CC=C(C=C3)SC

Isomeric SMILES

B1(OC2=CC(=C(C=C2O1)Cl)Cl)C3=CC=C(C=C3)SC

InChI

InChI=1S/C13H9BCl2O2S/c1-19-9-4-2-8(3-5-9)14-17-12-6-10(15)11(16)7-13(12)18-14/h2-7H,1H3