2,2,4-trimethylpentyl hexanoate

Systemtic Name: 2,2,4-trimethylpentyl hexanoate Openeye Name: 2,2,4-trimethylpentyl hexanoate CAS Name: hexanoic acid 2,2,4-trimethylpentyl ester IUPAC Name: 2,2,4-trimethylpentyl hexanoate Traditional Name: hexanoic acid 2,2,4-trimethylpentyl ester Formula: C14H28O2 MolecularWeight: 228.37092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OCC(C)(C)CC(C)C

Isomeric SMILES

CCCCCC(=O)OCC(C)(C)CC(C)C

InChI

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