2-tert-butyl-7-methyl-octanoic acid

Systemtic Name: 2-tert-butyl-7-methyl-octanoic acid Openeye Name: 2-tert-butyl-7-methyl-octanoic acid CAS Name: 2-tert-butyl-7-methyloctanoic acid IUPAC Name: 2-tert-butyl-7-methyloctanoic acid Traditional Name: 2-tert-butyl-7-methyl-caprylic acid Formula: C13H26O2 MolecularWeight: 214.34434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26O2/c1-10(2)8-6-7-9-11(12(14)15)13(3,4)5/h10-11H,6-9H2,1-5H3,(H,14,15)