3,4-bis(1-chloroethyl)phthalate

Systemtic Name: 3,4-bis(1-chloroethyl)phthalate Openeye Name: 3,4-bis(1-chloroethyl)phthalate CAS Name: 3,4-bis(1-chloroethyl)phthalate IUPAC Name: 3,4-bis(1-chloroethyl)phthalate Traditional Name: 3,4-bis(1-chloroethyl)phthalate Formula: C12H10Cl2O4-2 MolecularWeight: 289.1114

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])C(C)Cl)Cl

Isomeric SMILES

CC(C1=C(C(=C(C=C1)C(=O)[O-])C(=O)[O-])C(C)Cl)Cl

InChI

InChI=1S/C12H12Cl2O4/c1-5(13)7-3-4-8(11(15)16)10(12(17)18)9(7)6(2)14/h3-6H,1-2H3,(H,15,16)(H,17,18)/p-2