3,4-di(hexadecan-7-yl)phthalate

Systemtic Name: 3,4-di(hexadecan-7-yl)phthalate Openeye Name: 3,4-bis(1-hexyldecyl)phthalate CAS Name: 3,4-di(hexadecan-7-yl)phthalate IUPAC Name: 3,4-di(hexadecan-7-yl)phthalate Traditional Name: 3,4-bis(1-hexyldecyl)phthalate Formula: C40H68O4-2 MolecularWeight: 612.96552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(CCCCCC)C1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])C(CCCCCC)CCCCCCCCC

Isomeric SMILES

CCCCCCCCCC(CCCCCC)C1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])C(CCCCCC)CCCCCCCCC

InChI

InChI=1S/C40H70O4/c1-5-9-13-17-19-21-25-28-33(27-23-15-11-7-3)35-31-32-36(39(41)42)38(40(43)44)37(35)34(29-24-16-12-8-4)30-26-22-20-18-14-10-6-2/h31-34H,5-30H2,1-4H3,(H,41,42)(H,43,44)/p-2