1-[4,5-bis(chloranyl)-2-methyl-phenyl]propan-1-one; chloranylmethane

Systemtic Name: 1-[4,5-bis(chloranyl)-2-methyl-phenyl]propan-1-one; chloranylmethane Openeye Name: chloromethane; 1-(4,5-dichloro-2-methyl-phenyl)propan-1-one CAS Name: chloromethane; 1-(4,5-dichloro-2-methylphenyl)-1-propanone IUPAC Name: chloromethane; 1-(4,5-dichloro-2-methylphenyl)propan-1-one Traditional Name: chloromethane; 1-(4,5-dichloro-2-methyl-phenyl)propan-1-one Formula: C11H13Cl3O MolecularWeight: 267.57932

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=C(C=C1C)Cl)Cl.CCl

Isomeric SMILES

CCC(=O)C1=CC(=C(C=C1C)Cl)Cl.CCl

InChI

InChI=1S/C10H10Cl2O.CH3Cl/c1-3-10(13)7-5-9(12)8(11)4-6(7)2;1-2/h4-5H,3H2,1-2H3;1H3