3-oxidanylbutan-2-one; prop-2-enal

Systemtic Name: 3-oxidanylbutan-2-one; prop-2-enal Openeye Name: 3-hydroxybutan-2-one; prop-2-enal CAS Name: 3-hydroxy-2-butanone; 2-propenal IUPAC Name: 3-hydroxybutan-2-one; prop-2-enal Traditional Name: acrolein; 3-hydroxybutan-2-one Formula: C7H12O3 MolecularWeight: 144.16838

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C)O.C=CC=O

Isomeric SMILES

CC(C(=O)C)O.C=CC=O

InChI

InChI=1S/C4H8O2.C3H4O/c1-3(5)4(2)6;1-2-3-4/h3,5H,1-2H3;2-3H,1H2