3-[3-(hydroxymethyl)-6-oxidanyl-hexyl]-5-methyl-oxolan-2-one

Systemtic Name: 3-[3-(hydroxymethyl)-6-oxidanyl-hexyl]-5-methyl-oxolan-2-one Openeye Name: 3-[6-hydroxy-3-(hydroxymethyl)hexyl]-5-methyl-tetrahydrofuran-2-one CAS Name: 3-[6-hydroxy-3-(hydroxymethyl)hexyl]-5-methyl-2-oxolanone IUPAC Name: 3-[6-hydroxy-3-(hydroxymethyl)hexyl]-5-methyloxolan-2-one Traditional Name: 3-(6-hydroxy-3-methylol-hexyl)-5-methyl-tetrahydrofuran-2-one Formula: C12H22O4 MolecularWeight: 230.30068

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(=O)O1)CCC(CCCO)CO

Isomeric SMILES

CC1CC(C(=O)O1)CCC(CCCO)CO

InChI

InChI=1S/C12H22O4/c1-9-7-11(12(15)16-9)5-4-10(8-14)3-2-6-13/h9-11,13-14H,2-8H2,1H3