3-dodecan-5-ylphthalic acid

Systemtic Name: 3-dodecan-5-ylphthalic acid Openeye Name: 3-(1-butyloctyl)phthalic acid CAS Name: 3-dodecan-5-ylphthalic acid IUPAC Name: 3-dodecan-5-ylphthalic acid Traditional Name: 3-(1-butyloctyl)phthalic acid Formula: C20H30O4 MolecularWeight: 334.4498

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCC)C1=CC=CC(=C1C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCC(CCCC)C1=CC=CC(=C1C(=O)O)C(=O)O

InChI

InChI=1S/C20H30O4/c1-3-5-7-8-9-12-15(11-6-4-2)16-13-10-14-17(19(21)22)18(16)20(23)24/h10,13-15H,3-9,11-12H2,1-2H3,(H,21,22)(H,23,24)