ethyl ethanoate; 5-oxidanylpentan-2-one; propan-2-one

Systemtic Name: ethyl ethanoate; 5-oxidanylpentan-2-one; propan-2-one Openeye Name: acetone; ethyl acetate; 5-hydroxypentan-2-one CAS Name: acetic acid ethyl ester; 5-hydroxy-2-pentanone; 2-propanone IUPAC Name: ethyl acetate; 5-hydroxypentan-2-one; propan-2-one Traditional Name: acetic acid ethyl ester; acetone; 5-hydroxypentan-2-one Formula: C75H150O32 MolecularWeight: 1563.9743

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H10O2.10C4H8O2.10C3H6O/c1-5(7)3-2-4-6;10*1-3-6-4(2)5;10*1-3(2)4/h6H,2-4H2,1H3;10*3H2,1-2H3;10*1-2H3