ethanoic acid; ethyl 2,2-dihexyltetradecanoate

Systemtic Name: ethanoic acid; ethyl 2,2-dihexyltetradecanoate Openeye Name: acetic acid; ethyl 2,2-dihexyltetradecanoate CAS Name: acetic acid; 2,2-dihexyltetradecanoic acid ethyl ester IUPAC Name: acetic acid; ethyl 2,2-dihexyltetradecanoate Traditional Name: acetic acid; 2,2-dihexylmyristic acid ethyl ester Formula: C38H76O12 MolecularWeight: 725.00284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCC)(CCCCCC)C(=O)OCC.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCC)(CCCCCC)C(=O)OCC.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O.CC(=O)O

InChI

InChI=1S/C28H56O2.5C2H4O2/c1-5-9-12-15-16-17-18-19-20-23-26-28(27(29)30-8-4,24-21-13-10-6-2)25-22-14-11-7-3;5*1-2(3)4/h5-26H2,1-4H3;5*1H3,(H,3,4)