3-(hydroxymethyl)-3,5,5-trimethyl-cyclohexan-1-one

Systemtic Name: 3-(hydroxymethyl)-3,5,5-trimethyl-cyclohexan-1-one Openeye Name: 3-(hydroxymethyl)-3,5,5-trimethyl-cyclohexanone CAS Name: 3-(hydroxymethyl)-3,5,5-trimethyl-1-cyclohexanone IUPAC Name: 3-(hydroxymethyl)-3,5,5-trimethylcyclohexan-1-one Traditional Name: 3,3,5-trimethyl-5-methylol-cyclohexanone Formula: C10H18O2 MolecularWeight: 170.24872

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=O)CC(C1)(C)CO)C

Isomeric SMILES

CC1(CC(=O)CC(C1)(C)CO)C

InChI

InChI=1S/C10H18O2/c1-9(2)4-8(12)5-10(3,6-9)7-11/h11H,4-7H2,1-3H3