2-[4-(butylsulfanylmethyl)phenyl]-5,5-dimethyl-1,3,2-dioxaborinane

Systemtic Name: 2-[4-(butylsulfanylmethyl)phenyl]-5,5-dimethyl-1,3,2-dioxaborinane Openeye Name: 2-[4-(butylsulfanylmethyl)phenyl]-5,5-dimethyl-1,3,2-dioxaborinane CAS Name: 2-[4-[(butylthio)methyl]phenyl]-5,5-dimethyl-1,3,2-dioxaborinane IUPAC Name: 2-[4-(butylsulfanylmethyl)phenyl]-5,5-dimethyl-1,3,2-dioxaborinane Traditional Name: 2-[4-[(butylthio)methyl]phenyl]-5,5-dimethyl-1,3,2-dioxaborinane Formula: C16H25BO2S MolecularWeight: 292.2445

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Descriptors Computed from Structure

Canonical SMILES:

B1(OCC(CO1)(C)C)C2=CC=C(C=C2)CSCCCC

Isomeric SMILES

B1(OCC(CO1)(C)C)C2=CC=C(C=C2)CSCCCC

InChI

InChI=1S/C16H25BO2S/c1-4-5-10-20-11-14-6-8-15(9-7-14)17-18-12-16(2,3)13-19-17/h6-9H,4-5,10-13H2,1-3H3