2,2,4-trimethylpentyl 2-methyl-2-oxidanyl-propanoate

Systemtic Name: 2,2,4-trimethylpentyl 2-methyl-2-oxidanyl-propanoate Openeye Name: 2,2,4-trimethylpentyl 2-hydroxy-2-methyl-propanoate CAS Name: 2-hydroxy-2-methylpropanoic acid 2,2,4-trimethylpentyl ester IUPAC Name: 2,2,4-trimethylpentyl 2-hydroxy-2-methylpropanoate Traditional Name: 2-hydroxy-2-methyl-propionic acid 2,2,4-trimethylpentyl ester Formula: C12H24O3 MolecularWeight: 216.31716

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C)(C)COC(=O)C(C)(C)O

Isomeric SMILES

CC(C)CC(C)(C)COC(=O)C(C)(C)O

InChI

InChI=1S/C12H24O3/c1-9(2)7-11(3,4)8-15-10(13)12(5,6)14/h9,14H,7-8H2,1-6H3