(4-chlorophenyl)(4-methoxyphenyl)methanone

• ChemBase ID: 311645
• Molecular Formular: C14H11ClO2
• Molecular Mass: 246.68894
• Monoisotopic Mass: 246.04475727
• SMILES: C(=O)(c1ccc(cc1)Cl)c1ccc(cc1)OC
• Canonical SMILES: COc1ccc(cc1)C(=O)c1ccc(cc1)Cl
• InChI: InChI=1S/C14H11ClO2/c1-17-13-8-4-11(5-9-13)14(16)10-2-6-12(15)7-3-10/h2-9H,1H3
• InChIKey: JJVJYPSXZCEIEQ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: (4-chlorophenyl)(4-methoxyphenyl)methanone
• IUPAC Traditional name: (4-chlorophenyl)(4-methoxyphenyl)methanone
• Synonyms: (4-chlorophenyl)(4-methoxyphenyl)methanone

Database IDs

• CAS Number: 10547-60-1
• MDL Number: MFCD01105071

CALCULATED PROPERTIES

• H Acceptors: 2
• H Donor: 0
• LogD (pH = 5.5): 3.8789723
• LogD (pH = 7.4): 3.8789723
• Log P: 3.8789723
• Molar Refractivity: 67.9015 cm^3
• Polarizability: 26.356607 Å^3
• Polar Surface Area: 26.3 Å^2