4-methylpentan-2-yl 2-ethylhexanoate

Systemtic Name: 4-methylpentan-2-yl 2-ethylhexanoate Openeye Name: 1,3-dimethylbutyl 2-ethylhexanoate CAS Name: 2-ethylhexanoic acid 4-methylpentan-2-yl ester IUPAC Name: 4-methylpentan-2-yl 2-ethylhexanoate Traditional Name: 2-ethylhexanoic acid 1,3-dimethylbutyl ester Formula: C14H28O2 MolecularWeight: 228.37092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)OC(C)CC(C)C

Isomeric SMILES

CCCCC(CC)C(=O)OC(C)CC(C)C

InChI

InChI=1S/C14H28O2/c1-6-8-9-13(7-2)14(15)16-12(5)10-11(3)4/h11-13H,6-10H2,1-5H3