5-methyl-2-propan-2-yl-cyclohexan-1-one; propane-1,2,3-triol

Systemtic Name: 5-methyl-2-propan-2-yl-cyclohexan-1-one; propane-1,2,3-triol Openeye Name: glycerol; 2-isopropyl-5-methyl-cyclohexanone CAS Name: 5-methyl-2-propan-2-yl-1-cyclohexanone; propane-1,2,3-triol IUPAC Name: 5-methyl-2-propan-2-ylcyclohexan-1-one; propane-1,2,3-triol Traditional Name: glycerol; 2-isopropyl-5-methyl-cyclohexanone Formula: C13H26O4 MolecularWeight: 246.34314

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(C(=O)C1)C(C)C.C(C(CO)O)O

Isomeric SMILES

CC1CCC(C(=O)C1)C(C)C.C(C(CO)O)O

InChI

InChI=1S/C10H18O.C3H8O3/c1-7(2)9-5-4-8(3)6-10(9)11;4-1-3(6)2-5/h7-9H,4-6H2,1-3H3;3-6H,1-2H2