4,4-bis(chloranyl)-2-methyl-5-phenyl-pentanal

Systemtic Name: 4,4-bis(chloranyl)-2-methyl-5-phenyl-pentanal Openeye Name: 4,4-dichloro-2-methyl-5-phenyl-pentanal CAS Name: 4,4-dichloro-2-methyl-5-phenylpentanal IUPAC Name: 4,4-dichloro-2-methyl-5-phenylpentanal Traditional Name: 4,4-dichloro-2-methyl-5-phenyl-valeraldehyde Formula: C12H14Cl2O MolecularWeight: 245.14496

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(CC1=CC=CC=C1)(Cl)Cl)C=O

Isomeric SMILES

CC(CC(CC1=CC=CC=C1)(Cl)Cl)C=O

InChI

InChI=1S/C12H14Cl2O/c1-10(9-15)7-12(13,14)8-11-5-3-2-4-6-11/h2-6,9-10H,7-8H2,1H3