1,4-bis(chloranyl)butane; heptan-3-one

Systemtic Name: 1,4-bis(chloranyl)butane; heptan-3-one Openeye Name: 1,4-dichlorobutane; heptan-3-one CAS Name: 1,4-dichlorobutane; 3-heptanone IUPAC Name: 1,4-dichlorobutane; heptan-3-one Traditional Name: 1,4-dichlorobutane; heptan-3-one Formula: C11H22Cl2O MolecularWeight: 241.19778

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CC.C(CCCl)CCl

Isomeric SMILES

CCCCC(=O)CC.C(CCCl)CCl

InChI

InChI=1S/C7H14O.C4H8Cl2/c1-3-5-6-7(8)4-2;5-3-1-2-4-6/h3-6H2,1-2H3;1-4H2