propyl 3,5,5-trimethylhexanoate

Systemtic Name: propyl 3,5,5-trimethylhexanoate Openeye Name: propyl 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid propyl ester IUPAC Name: propyl 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid propyl ester Formula: C12H24O2 MolecularWeight: 200.31776

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCCOC(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C12H24O2/c1-6-7-14-11(13)8-10(2)9-12(3,4)5/h10H,6-9H2,1-5H3