hexakis(2-ethylhexyl) cyclohexane-1,1,2,2,3,3-hexacarboxylate

Systemtic Name: hexakis(2-ethylhexyl) cyclohexane-1,1,2,2,3,3-hexacarboxylate Openeye Name: hexakis(2-ethylhexyl) cyclohexane-1,1,2,2,3,3-hexacarboxylate CAS Name: cyclohexane-1,1,2,2,3,3-hexacarboxylic acid hexakis(2-ethylhexyl) ester IUPAC Name: hexakis(2-ethylhexyl) cyclohexane-1,1,2,2,3,3-hexacarboxylate Traditional Name: cyclohexane-1,1,2,2,3,3-hexacarboxylic acid hexakis(2-ethylhexyl) ester Formula: C60H108O12 MolecularWeight: 1021.49232

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)COC(=O)C1(CCCC(C1(C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)(C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC

Isomeric SMILES

CCCCC(CC)COC(=O)C1(CCCC(C1(C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)(C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC

InChI

InChI=1S/C60H108O12/c1-13-25-32-46(19-7)40-67-52(61)58(53(62)68-41-47(20-8)33-26-14-2)38-31-39-59(54(63)69-42-48(21-9)34-27-15-3,55(64)70-43-49(22-10)35-28-16-4)60(58,56(65)71-44-50(23-11)36-29-17-5)57(66)72-45-51(24-12)37-30-18-6/h46-51H,13-45H2,1-12H3