butyl ethanoate; propane-1,2-diol

Systemtic Name: butyl ethanoate; propane-1,2-diol Openeye Name: butyl acetate; propane-1,2-diol CAS Name: acetic acid butyl ester; propane-1,2-diol IUPAC Name: butyl acetate; propane-1,2-diol Traditional Name: acetic acid butyl ester; propane-1,2-diol Formula: C9H20O4 MolecularWeight: 192.2527

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H12O2.C3H8O2/c1-3-4-5-8-6(2)7;1-3(5)2-4/h3-5H2,1-2H3;3-5H,2H2,1H3