decanedioic acid; decane-1,10-diol

Systemtic Name: decanedioic acid; decane-1,10-diol Openeye Name: decanedioic acid; decane-1,10-diol CAS Name: decanedioic acid; decane-1,10-diol IUPAC Name: decanedioic acid; decane-1,10-diol Traditional Name: decane-1,10-diol; sebacic acid Formula: C20H40O6 MolecularWeight: 376.528

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Descriptors Computed from Structure

Canonical SMILES:

C(CCCCCO)CCCCO.C(CCCCC(=O)O)CCCC(=O)O

Isomeric SMILES

C(CCCCCO)CCCCO.C(CCCCC(=O)O)CCCC(=O)O

InChI

InChI=1S/C10H18O4.C10H22O2/c11-9(12)7-5-3-1-2-4-6-8-10(13)14;11-9-7-5-3-1-2-4-6-8-10-12/h1-8H2,(H,11,12)(H,13,14);11-12H,1-10H2