2-methylpropyl 2-methyl-2-oxidanyl-hexanoate

Systemtic Name: 2-methylpropyl 2-methyl-2-oxidanyl-hexanoate Openeye Name: isobutyl 2-hydroxy-2-methyl-hexanoate CAS Name: 2-hydroxy-2-methylhexanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-hydroxy-2-methylhexanoate Traditional Name: 2-hydroxy-2-methyl-hexanoic acid isobutyl ester Formula: C11H22O3 MolecularWeight: 202.29058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(C(=O)OCC(C)C)O

Isomeric SMILES

CCCCC(C)(C(=O)OCC(C)C)O

InChI

InChI=1S/C11H22O3/c1-5-6-7-11(4,13)10(12)14-8-9(2)3/h9,13H,5-8H2,1-4H3