2,2-bis(2-ethylhexyl)decanedioate; 2,6-ditert-butyl-4-methyl-phenol

Systemtic Name: 2,2-bis(2-ethylhexyl)decanedioate; 2,6-ditert-butyl-4-methyl-phenol Openeye Name: 2,2-bis(2-ethylhexyl)decanedioate; 2,6-ditert-butyl-4-methyl-phenol CAS Name: 2,2-bis(2-ethylhexyl)decanedioate; 2,6-ditert-butyl-4-methylphenol IUPAC Name: 2,2-bis(2-ethylhexyl)decanedioate; 2,6-ditert-butyl-4-methylphenol Traditional Name: 2,2-bis(2-ethylhexyl)sebacate; 2,6-ditert-butyl-4-methyl-phenol Formula: C41H72O5-2 MolecularWeight: 645.00738

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC(CCCCCCCC(=O)[O-])(CC(CC)CCCC)C(=O)[O-].CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

Isomeric SMILES

CCCCC(CC)CC(CCCCCCCC(=O)[O-])(CC(CC)CCCC)C(=O)[O-].CC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C

InChI

InChI=1S/C26H50O4.C15H24O/c1-5-9-16-22(7-3)20-26(25(29)30,21-23(8-4)17-10-6-2)19-15-13-11-12-14-18-24(27)28;1-10-8-11(14(2,3)4)13(16)12(9-10)15(5,6)7/h22-23H,5-21H2,1-4H3,(H,27,28)(H,29,30);8-9,16H,1-7H3/p-2