3-[4-(hydroxymethyl)-4-methyl-cyclohexyl]oxy-2-methyl-propane-1,1-diol

Systemtic Name: 3-[4-(hydroxymethyl)-4-methyl-cyclohexyl]oxy-2-methyl-propane-1,1-diol Openeye Name: 3-[4-(hydroxymethyl)-4-methyl-cyclohexoxy]-2-methyl-propane-1,1-diol CAS Name: 3-[4-(hydroxymethyl)-4-methylcyclohexyl]oxy-2-methylpropane-1,1-diol IUPAC Name: 3-[4-(hydroxymethyl)-4-methylcyclohexyl]oxy-2-methylpropane-1,1-diol Traditional Name: 2-methyl-3-(4-methyl-4-methylol-cyclohexoxy)propane-1,1-diol Formula: C12H24O4 MolecularWeight: 232.31656

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC1CCC(CC1)(C)CO)C(O)O

Isomeric SMILES

CC(COC1CCC(CC1)(C)CO)C(O)O

InChI

InChI=1S/C12H24O4/c1-9(11(14)15)7-16-10-3-5-12(2,8-13)6-4-10/h9-11,13-15H,3-8H2,1-2H3