3,3,7,7-tetramethyl-1,2-dioxepan-5-one

Systemtic Name: 3,3,7,7-tetramethyl-1,2-dioxepan-5-one Openeye Name: 3,3,7,7-tetramethyldioxepan-5-one CAS Name: 3,3,7,7-tetramethyl-5-dioxepanone IUPAC Name: 3,3,7,7-tetramethyldioxepan-5-one Traditional Name: 3,3,7,7-tetramethyldioxepan-5-one Formula: C9H16O3 MolecularWeight: 172.22154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC(OO1)(C)C)C

Isomeric SMILES

CC1(CC(=O)CC(OO1)(C)C)C

InChI

InChI=1S/C9H16O3/c1-8(2)5-7(10)6-9(3,4)12-11-8/h5-6H2,1-4H3