ethyl ethanoate; hexane; propan-2-ol; hydrate

Systemtic Name: ethyl ethanoate; hexane; propan-2-ol; hydrate Openeye Name: ethyl acetate; hexane; propan-2-ol; hydrate CAS Name: acetic acid ethyl ester; hexane; 2-propanol; hydrate IUPAC Name: ethyl acetate; hexane; propan-2-ol; hydrate Traditional Name: acetic acid ethyl ester; n-hexane; propan-2-ol; hydrate Formula: C13H32O4 MolecularWeight: 252.39078

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC.CCOC(=O)C.CC(C)O.O

Isomeric SMILES

CCCCCC.CCOC(=O)C.CC(C)O.O

InChI

InChI=1S/C6H14.C4H8O2.C3H8O.H2O/c1-3-5-6-4-2;1-3-6-4(2)5;1-3(2)4;/h3-6H2,1-2H3;3H2,1-2H3;3-4H,1-2H3;1H2