2,2-bis(2-ethylhexyl)dodecanedioate

Systemtic Name: 2,2-bis(2-ethylhexyl)dodecanedioate Openeye Name: 2,2-bis(2-ethylhexyl)dodecanedioate CAS Name: 2,2-bis(2-ethylhexyl)dodecanedioate IUPAC Name: 2,2-bis(2-ethylhexyl)dodecanedioate Traditional Name: 2,2-bis(2-ethylhexyl)dodecanedioate Formula: C28H52O4-2 MolecularWeight: 452.71008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CCCCCCCCCC(=O)[O-])(CC(CC)CCCC)C(=O)[O-]

Isomeric SMILES

CCCCC(CC)CC(CCCCCCCCCC(=O)[O-])(CC(CC)CCCC)C(=O)[O-]

InChI

InChI=1S/C28H54O4/c1-5-9-18-24(7-3)22-28(27(31)32,23-25(8-4)19-10-6-2)21-17-15-13-11-12-14-16-20-26(29)30/h24-25H,5-23H2,1-4H3,(H,29,30)(H,31,32)/p-2