ethyl 3,3-bis(chloranyl)propanoate; hexane

Systemtic Name: ethyl 3,3-bis(chloranyl)propanoate; hexane Openeye Name: ethyl 3,3-dichloropropanoate; hexane CAS Name: 3,3-dichloropropanoic acid ethyl ester; hexane IUPAC Name: ethyl 3,3-dichloropropanoate; hexane Traditional Name: 3,3-dichloropropionic acid ethyl ester; n-hexane Formula: C11H22Cl2O2 MolecularWeight: 257.19718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H14.C5H8Cl2O2/c1-3-5-6-4-2;1-2-9-5(8)3-4(6)7/h3-6H2,1-2H3;4H,2-3H2,1H3