[2-(hydroxymethyl)-2-methyl-pentyl] 3-methylbutanoate

Systemtic Name: [2-(hydroxymethyl)-2-methyl-pentyl] 3-methylbutanoate Openeye Name: [2-(hydroxymethyl)-2-methyl-pentyl] 3-methylbutanoate CAS Name: 3-methylbutanoic acid [2-(hydroxymethyl)-2-methylpentyl] ester IUPAC Name: [2-(hydroxymethyl)-2-methylpentyl] 3-methylbutanoate Traditional Name: 3-methylbutyric acid (2-methyl-2-methylol-pentyl) ester Formula: C12H24O3 MolecularWeight: 216.31716

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)(CO)COC(=O)CC(C)C

Isomeric SMILES

CCCC(C)(CO)COC(=O)CC(C)C

InChI

InChI=1S/C12H24O3/c1-5-6-12(4,8-13)9-15-11(14)7-10(2)3/h10,13H,5-9H2,1-4H3