2-(2,2-dimethylpropyl)octadecanoic acid

Systemtic Name: 2-(2,2-dimethylpropyl)octadecanoic acid Openeye Name: 2-(2,2-dimethylpropyl)octadecanoic acid CAS Name: 2-(2,2-dimethylpropyl)octadecanoic acid IUPAC Name: 2-(2,2-dimethylpropyl)octadecanoic acid Traditional Name: 2-neopentylstearic acid Formula: C23H46O2 MolecularWeight: 354.61014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC(CC(C)(C)C)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCC(CC(C)(C)C)C(=O)O

InChI

InChI=1S/C23H46O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21(22(24)25)20-23(2,3)4/h21H,5-20H2,1-4H3,(H,24,25)