dodecanoate; propane-1,2-diol

Systemtic Name: dodecanoate; propane-1,2-diol Openeye Name: dodecanoate; propane-1,2-diol CAS Name: dodecanoate; propane-1,2-diol IUPAC Name: dodecanoate; propane-1,2-diol Traditional Name: laurate; propane-1,2-diol Formula: C15H31O4- MolecularWeight: 275.40424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)[O-].CC(CO)O

Isomeric SMILES

CCCCCCCCCCCC(=O)[O-].CC(CO)O

InChI

InChI=1S/C12H24O2.C3H8O2/c1-2-3-4-5-6-7-8-9-10-11-12(13)14;1-3(5)2-4/h2-11H2,1H3,(H,13,14);3-5H,2H2,1H3/p-1