3-(2,3-dimethylpentan-2-yl)octanoic acid

Systemtic Name: 3-(2,3-dimethylpentan-2-yl)octanoic acid Openeye Name: 3-(1,1,2-trimethylbutyl)octanoic acid CAS Name: 3-(2,3-dimethylpentan-2-yl)octanoic acid IUPAC Name: 3-(2,3-dimethylpentan-2-yl)octanoic acid Traditional Name: 3-(1,1,2-trimethylbutyl)caprylic acid Formula: C15H30O2 MolecularWeight: 242.3975

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC(=O)O)C(C)(C)C(C)CC

Isomeric SMILES

CCCCCC(CC(=O)O)C(C)(C)C(C)CC

InChI

InChI=1S/C15H30O2/c1-6-8-9-10-13(11-14(16)17)15(4,5)12(3)7-2/h12-13H,6-11H2,1-5H3,(H,16,17)