tert-butyl 3,5,5-trimethylhexanoate

Systemtic Name: tert-butyl 3,5,5-trimethylhexanoate Openeye Name: tert-butyl 3,5,5-trimethylhexanoate CAS Name: 3,5,5-trimethylhexanoic acid tert-butyl ester IUPAC Name: tert-butyl 3,5,5-trimethylhexanoate Traditional Name: 3,5,5-trimethylhexanoic acid tert-butyl ester Formula: C13H26O2 MolecularWeight: 214.34434

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H26O2/c1-10(9-12(2,3)4)8-11(14)15-13(5,6)7/h10H,8-9H2,1-7H3