butyl prop-2-ynoate; propane-1,2-diol

Systemtic Name: butyl prop-2-ynoate; propane-1,2-diol Openeye Name: butyl prop-2-ynoate; propane-1,2-diol CAS Name: propane-1,2-diol; 2-propynoic acid butyl ester IUPAC Name: butyl prop-2-ynoate; propane-1,2-diol Traditional Name: propane-1,2-diol; propiolic acid butyl ester Formula: C10H18O4 MolecularWeight: 202.24752

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C#C.CC(CO)O

Isomeric SMILES

CCCCOC(=O)C#C.CC(CO)O

InChI

InChI=1S/C7H10O2.C3H8O2/c1-3-5-6-9-7(8)4-2;1-3(5)2-4/h2H,3,5-6H2,1H3;3-5H,2H2,1H3