2-tert-butylperoxy-7-methyl-octanoic acid

Systemtic Name: 2-tert-butylperoxy-7-methyl-octanoic acid Openeye Name: 2-tert-butylperoxy-7-methyl-octanoic acid CAS Name: 2-tert-butyldioxy-7-methyloctanoic acid IUPAC Name: 2-tert-butylperoxy-7-methyloctanoic acid Traditional Name: 2-tert-butylperoxy-7-methyl-caprylic acid Formula: C13H26O4 MolecularWeight: 246.34314

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCC(C(=O)O)OOC(C)(C)C

Isomeric SMILES

CC(C)CCCCC(C(=O)O)OOC(C)(C)C

InChI

InChI=1S/C13H26O4/c1-10(2)8-6-7-9-11(12(14)15)16-17-13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,15)