chloranylbenzene; 2-chloranyl-2-methyl-butane; propan-2-one

Systemtic Name: chloranylbenzene; 2-chloranyl-2-methyl-butane; propan-2-one Openeye Name: acetone; chlorobenzene; 2-chloro-2-methyl-butane CAS Name: chlorobenzene; 2-chloro-2-methylbutane; 2-propanone IUPAC Name: chlorobenzene; 2-chloro-2-methylbutane; propan-2-one Traditional Name: acetone; chlorobenzene; 2-chloro-2-methyl-butane Formula: C14H22Cl2O MolecularWeight: 277.22988

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H5Cl.C5H11Cl.C3H6O/c7-6-4-2-1-3-5-6;1-4-5(2,3)6;1-3(2)4/h1-5H;4H2,1-3H3;1-2H3