methyl 5,5-dimethylhexanoate

Systemtic Name: methyl 5,5-dimethylhexanoate Openeye Name: methyl 5,5-dimethylhexanoate CAS Name: 5,5-dimethylhexanoic acid methyl ester IUPAC Name: methyl 5,5-dimethylhexanoate Traditional Name: 5,5-dimethylhexanoic acid methyl ester Formula: C9H18O2 MolecularWeight: 158.23802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H18O2/c1-9(2,3)7-5-6-8(10)11-4/h5-7H2,1-4H3