[2-[2-(dioxidanyl)-4-methyl-pentan-2-yl]peroxy-4-methyl-pentan-2-yl] ethaneperoxoate

Systemtic Name: [2-[2-(dioxidanyl)-4-methyl-pentan-2-yl]peroxy-4-methyl-pentan-2-yl] ethaneperoxoate Openeye Name: [1-(1-hydroperoxy-1,3-dimethyl-butyl)peroxy-1,3-dimethyl-butyl] peroxyacetate CAS Name: ethaneperoxoic acid [2-(2-hydroperoxy-4-methylpentan-2-yl)dioxy-4-methylpentan-2-yl] ester IUPAC Name: [2-(2-hydroperoxy-4-methylpentan-2-yl)peroxy-4-methylpentan-2-yl] ethaneperoxoate Traditional Name: peracetic acid [1-(1-hydroperoxy-1,3-dimethyl-butyl)peroxy-1,3-dimethyl-butyl] ester Formula: C14H28O7 MolecularWeight: 308.36792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)(OO)OOC(C)(CC(C)C)OOC(=O)C

Isomeric SMILES

CC(C)CC(C)(OO)OOC(C)(CC(C)C)OOC(=O)C

InChI

InChI=1S/C14H28O7/c1-10(2)8-13(6,18-16)20-21-14(7,9-11(3)4)19-17-12(5)15/h10-11,16H,8-9H2,1-7H3