3,4-bis(2,3-dimethylpentyl)phthalate

Systemtic Name: 3,4-bis(2,3-dimethylpentyl)phthalate Openeye Name: 3,4-bis(2,3-dimethylpentyl)phthalate CAS Name: 3,4-bis(2,3-dimethylpentyl)phthalate IUPAC Name: 3,4-bis(2,3-dimethylpentyl)phthalate Traditional Name: 3,4-bis(2,3-dimethylpentyl)phthalate Formula: C22H32O4-2 MolecularWeight: 360.48708

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C)CC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CC(C)C(C)CC

Isomeric SMILES

CCC(C)C(C)CC1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])CC(C)C(C)CC

InChI

InChI=1S/C22H34O4/c1-7-13(3)15(5)11-17-9-10-18(21(23)24)20(22(25)26)19(17)12-16(6)14(4)8-2/h9-10,13-16H,7-8,11-12H2,1-6H3,(H,23,24)(H,25,26)/p-2