octanoyl octaneperoxoate; 3,5,5-trimethylhexanoyl 3,5,5-trimethylhexaneperoxoate

Systemtic Name: octanoyl octaneperoxoate; 3,5,5-trimethylhexanoyl 3,5,5-trimethylhexaneperoxoate Openeye Name: octanoyl octaneperoxoate; 3,5,5-trimethylhexanoyl 3,5,5-trimethylhexaneperoxoate CAS Name: octaneperoxoic acid 1-oxooctyl ester; 3,5,5-trimethylhexaneperoxoic acid (3,5,5-trimethyl-1-oxohexyl) ester IUPAC Name: octanoyl octaneperoxoate; 3,5,5-trimethylhexanoyl 3,5,5-trimethylhexaneperoxoate Traditional Name: peroxycaprylic acid caprylyl ester; 3,5,5-trimethylhexaneperoxoic acid 3,5,5-trimethylhexanoyl ester Formula: C34H64O8 MolecularWeight: 600.86716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OOC(=O)CCCCCCC.CC(CC(=O)OOC(=O)CC(C)CC(C)(C)C)CC(C)(C)C

Isomeric SMILES

CCCCCCCC(=O)OOC(=O)CCCCCCC.CC(CC(=O)OOC(=O)CC(C)CC(C)(C)C)CC(C)(C)C

InChI

InChI=1S/C18H34O4.C16H30O4/c1-13(11-17(3,4)5)9-15(19)21-22-16(20)10-14(2)12-18(6,7)8;1-3-5-7-9-11-13-15(17)19-20-16(18)14-12-10-8-6-4-2/h13-14H,9-12H2,1-8H3;3-14H2,1-2H3