4-(hydroxymethyl)-4-(phenylmethylsulfanyl)oxolan-2-one

Systemtic Name: 4-(hydroxymethyl)-4-(phenylmethylsulfanyl)oxolan-2-one Openeye Name: 4-benzylsulfanyl-4-(hydroxymethyl)tetrahydrofuran-2-one CAS Name: 4-(hydroxymethyl)-4-(phenylmethylthio)-2-oxolanone IUPAC Name: 4-benzylsulfanyl-4-(hydroxymethyl)oxolan-2-one Traditional Name: 4-(benzylthio)-4-methylol-tetrahydrofuran-2-one Formula: C12H14O3S MolecularWeight: 238.30276

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)OCC1(CO)SCC2=CC=CC=C2

Isomeric SMILES

C1C(=O)OCC1(CO)SCC2=CC=CC=C2

InChI

InChI=1S/C12H14O3S/c13-8-12(6-11(14)15-9-12)16-7-10-4-2-1-3-5-10/h1-5,13H,6-9H2