2-tert-butyl-7-methyl-octaneperoxoic acid

Systemtic Name: 2-tert-butyl-7-methyl-octaneperoxoic acid Openeye Name: 2-tert-butyl-7-methyl-octaneperoxoic acid CAS Name: 2-tert-butyl-7-methyloctaneperoxoic acid IUPAC Name: 2-tert-butyl-7-methyloctaneperoxoic acid Traditional Name: 2-tert-butyl-7-methyl-peroxycaprylic acid Formula: C13H26O3 MolecularWeight: 230.34374

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCC(C(=O)OO)C(C)(C)C

Isomeric SMILES

CC(C)CCCCC(C(=O)OO)C(C)(C)C

InChI

InChI=1S/C13H26O3/c1-10(2)8-6-7-9-11(12(14)16-15)13(3,4)5/h10-11,15H,6-9H2,1-5H3