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ethyl octanoate; octanoic acid

ethyl octanoate; octanoic acid

Systemtic Name:ethyl octanoate; octanoic acid
Openeye Name:ethyl octanoate; octanoic acid
CAS Name:octanoic acid; octanoic acid ethyl ester
IUPAC Name:ethyl octanoate; octanoic acid
Traditional Name:caprylic acid; caprylic acid ethyl ester
Formula: C18H36O4
MolecularWeight: 316.47604
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)O.CCCCCCCC(=O)OCC


Isomeric SMILES

CCCCCCCC(=O)O.CCCCCCCC(=O)OCC


InChI

InChI=1S/C10H20O2.C8H16O2/c1-3-5-6-7-8-9-10(11)12-4-2;1-2-3-4-5-6-7-8(9)10/h3-9H2,1-2H3;2-7H2,1H3,(H,9,10)


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