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heptan-4-one

heptan-4-one

Systemtic Name:heptan-4-one
Openeye Name:heptan-4-one
CAS Name:4-heptanone
IUPAC Name:heptan-4-one
Traditional Name:heptan-4-one
Formula: C14H28O2
MolecularWeight: 228.37092
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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)CCC.CCCC(=O)CCC


Isomeric SMILES

CCCC(=O)CCC.CCCC(=O)CCC


InChI

InChI=1S/2C7H14O/c2*1-3-5-7(8)6-4-2/h2*3-6H2,1-2H3


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