ethane-1,2-diol; 3-hexan-3-yloxyhexane

Systemtic Name: ethane-1,2-diol; 3-hexan-3-yloxyhexane Openeye Name: 3-(1-ethylbutoxy)hexane; ethylene glycol CAS Name: ethane-1,2-diol; 3-hexan-3-yloxyhexane IUPAC Name: ethane-1,2-diol; 3-hexan-3-yloxyhexane Traditional Name: 3-(1-ethylbutoxy)hexane; ethylene glycol Formula: C14H32O3 MolecularWeight: 248.40208

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)OC(CC)CCC.C(CO)O

Isomeric SMILES

CCCC(CC)OC(CC)CCC.C(CO)O

InChI

InChI=1S/C12H26O.C2H6O2/c1-5-9-11(7-3)13-12(8-4)10-6-2;3-1-2-4/h11-12H,5-10H2,1-4H3;3-4H,1-2H2