decanedioic acid; hexanedioic acid; propane-1,2-diol

Systemtic Name: decanedioic acid; hexanedioic acid; propane-1,2-diol Openeye Name: adipic acid; decanedioic acid; propane-1,2-diol CAS Name: decanedioic acid; hexanedioic acid; propane-1,2-diol IUPAC Name: decanedioic acid; hexanedioic acid; propane-1,2-diol Traditional Name: adipic acid; propane-1,2-diol; sebacic acid Formula: C19H36O10 MolecularWeight: 424.48314

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)O.C(CCCCC(=O)O)CCCC(=O)O.C(CCC(=O)O)CC(=O)O

Isomeric SMILES

CC(CO)O.C(CCCCC(=O)O)CCCC(=O)O.C(CCC(=O)O)CC(=O)O

InChI

InChI=1S/C10H18O4.C6H10O4.C3H8O2/c11-9(12)7-5-3-1-2-4-6-8-10(13)14;7-5(8)3-1-2-4-6(9)10;1-3(5)2-4/h1-8H2,(H,11,12)(H,13,14);1-4H2,(H,7,8)(H,9,10);3-5H,2H2,1H3