hex-1-yn-3-yl methanesulfonate

Systemtic Name: hex-1-yn-3-yl methanesulfonate Openeye Name: 1-ethynylbutyl methanesulfonate CAS Name: methanesulfonic acid hex-1-yn-3-yl ester IUPAC Name: hex-1-yn-3-yl methanesulfonate Traditional Name: methanesulfonic acid 1-propylprop-2-ynyl ester Formula: C7H12O3S MolecularWeight: 176.23338

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#C)OS(=O)(=O)C

Isomeric SMILES

CCCC(C#C)OS(=O)(=O)C

InChI

InChI=1S/C7H12O3S/c1-4-6-7(5-2)10-11(3,8)9/h2,7H,4,6H2,1,3H3