1,3-dimethylcyclohexane; 2-methylpropanoic acid

Systemtic Name: 1,3-dimethylcyclohexane; 2-methylpropanoic acid Openeye Name: 1,3-dimethylcyclohexane; 2-methylpropanoic acid CAS Name: 1,3-dimethylcyclohexane; 2-methylpropanoic acid IUPAC Name: 1,3-dimethylcyclohexane; 2-methylpropanoic acid Traditional Name: 1,3-dimethylcyclohexane; isobutyric acid Formula: C12H24O2 MolecularWeight: 200.31776

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)C.CC(C)C(=O)O

Isomeric SMILES

CC1CCCC(C1)C.CC(C)C(=O)O

InChI

InChI=1S/C8H16.C4H8O2/c1-7-4-3-5-8(2)6-7;1-3(2)4(5)6/h7-8H,3-6H2,1-2H3;3H,1-2H3,(H,5,6)