butan-2-yl 7,7-dimethyloctanoate

Systemtic Name: butan-2-yl 7,7-dimethyloctanoate Openeye Name: sec-butyl 7,7-dimethyloctanoate CAS Name: 7,7-dimethyloctanoic acid butan-2-yl ester IUPAC Name: butan-2-yl 7,7-dimethyloctanoate Traditional Name: 7,7-dimethylcaprylic acid sec-butyl ester Formula: C14H28O2 MolecularWeight: 228.37092

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC(=O)CCCCCC(C)(C)C

Isomeric SMILES

CCC(C)OC(=O)CCCCCC(C)(C)C

InChI

InChI=1S/C14H28O2/c1-6-12(2)16-13(15)10-8-7-9-11-14(3,4)5/h12H,6-11H2,1-5H3