(4-propan-2-ylsulfanylphenyl)boronic acid

Systemtic Name: (4-propan-2-ylsulfanylphenyl)boronic acid Openeye Name: (4-isopropylsulfanylphenyl)boronic acid CAS Name: [4-(propan-2-ylthio)phenyl]boronic acid IUPAC Name: (4-propan-2-ylsulfanylphenyl)boronic acid Traditional Name: [4-(isopropylthio)phenyl]boronic acid Formula: C9H13BO2S MolecularWeight: 196.07432

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Descriptors Computed from Structure

Canonical SMILES:

B(C1=CC=C(C=C1)SC(C)C)(O)O

Isomeric SMILES

B(C1=CC=C(C=C1)SC(C)C)(O)O

InChI

InChI=1S/C9H13BO2S/c1-7(2)13-9-5-3-8(4-6-9)10(11)12/h3-7,11-12H,1-2H3