9-(2,2-dimethyl-3-oxidanyl-propoxy)-9-oxidanylidene-nonanoate; dodecane

Systemtic Name: 9-(2,2-dimethyl-3-oxidanyl-propoxy)-9-oxidanylidene-nonanoate; dodecane Openeye Name: dodecane; 9-(3-hydroxy-2,2-dimethyl-propoxy)-9-oxo-nonanoate CAS Name: dodecane; 9-(3-hydroxy-2,2-dimethylpropoxy)-9-oxononanoate IUPAC Name: dodecane; 9-(3-hydroxy-2,2-dimethylpropoxy)-9-oxononanoate Traditional Name: dodecane; 9-(3-hydroxy-2,2-dimethyl-propoxy)-9-keto-pelargonate Formula: C26H51O5- MolecularWeight: 443.68014

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC.CC(C)(CO)COC(=O)CCCCCCCC(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCC.CC(C)(CO)COC(=O)CCCCCCCC(=O)[O-]

InChI

InChI=1S/C14H26O5.C12H26/c1-14(2,10-15)11-19-13(18)9-7-5-3-4-6-8-12(16)17;1-3-5-7-9-11-12-10-8-6-4-2/h15H,3-11H2,1-2H3,(H,16,17);3-12H2,1-2H3/p-1