3-(3,5,5-trimethylhexyl)phthalic acid

Systemtic Name: 3-(3,5,5-trimethylhexyl)phthalic acid Openeye Name: 3-(3,5,5-trimethylhexyl)phthalic acid CAS Name: 3-(3,5,5-trimethylhexyl)phthalic acid IUPAC Name: 3-(3,5,5-trimethylhexyl)phthalic acid Traditional Name: 3-(3,5,5-trimethylhexyl)phthalic acid Formula: C17H24O4 MolecularWeight: 292.37006

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=CC(=C1C(=O)O)C(=O)O)CC(C)(C)C

Isomeric SMILES

CC(CCC1=CC=CC(=C1C(=O)O)C(=O)O)CC(C)(C)C

InChI

InChI=1S/C17H24O4/c1-11(10-17(2,3)4)8-9-12-6-5-7-13(15(18)19)14(12)16(20)21/h5-7,11H,8-10H2,1-4H3,(H,18,19)(H,20,21)