butane-1,1-diol; pentane-1,5-diol; propane-1,2-diol

Systemtic Name: butane-1,1-diol; pentane-1,5-diol; propane-1,2-diol Openeye Name: butane-1,1-diol; pentane-1,5-diol; propane-1,2-diol CAS Name: butane-1,1-diol; pentane-1,5-diol; propane-1,2-diol IUPAC Name: butane-1,1-diol; pentane-1,5-diol; propane-1,2-diol Traditional Name: butane-1,1-diol; pentane-1,5-diol; propane-1,2-diol Formula: C12H30O6 MolecularWeight: 270.363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(O)O.CC(CO)O.C(CCO)CCO

Isomeric SMILES

CCCC(O)O.CC(CO)O.C(CCO)CCO

InChI

InChI=1S/C5H12O2.C4H10O2.C3H8O2/c6-4-2-1-3-5-7;1-2-3-4(5)6;1-3(5)2-4/h6-7H,1-5H2;4-6H,2-3H2,1H3;3-5H,2H2,1H3