CAS 1023-17-2|1-(4-methoxyphenyl)-2-phenylethan-1-one|p-ANISYL BENZYL KETONE|1-(4-methoxyphenyl)-2-phenylethanone|2-Phenyl-p-methoxyacetophenone|Benzyl p-Methoxyphenyl Ketone|4-Methoxy-α-phenylacet...

General Information

Structure

Molecular Formula

C₁₅H₁₄O₂

Molecular Mass

226.27046

Exact Mass

226.09937969

Charge

InChI

InChI=1S/C15H14O2/c1-17-14-9-7-13(8-10-14)15(16)11-12-5-3-2-4-6-12/h2-10H,11H2,1H3

InChIKey

PLALKSRAHVYFOH-UHFFFAOYSA-N

Canonic Smiles

COc1ccc(cc1)C(=O)Cc1ccccc1

Isomeric Smiles

O=C(c1ccc(cc1)OC)Cc1ccccc1

Calculated Properties

JChem

Acid pKa

16.475431

H Acceptors

H Donor

LogD (pH = 5.5)

3.207562

LogD (pH = 7.4)

3.207562

Log P

3.207562

Molar Refractivity

67.6459

Polarizability

26.188902

Polar Surface Area

26.3

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Commercial Catalog

Academic Data

Data Source

Names and Identifiers

IUPAC name

1-(4-methoxyphenyl)-2-phenylethan-1-one

Synonyms

p-ANISYL BENZYL KETONEBenzyl p-Methoxyphenyl Ketone4-Methoxy-α-phenylacetophenone2-Phenyl-p-methoxyacetophenone4-Methoxydeoxybenzoin1-(4-Methoxyphenyl)-2-phenyl-ethanone1-(4-Methoxyphenyl)acetophenoneNSC 26658p-Anisyl Benzyl KetoneBenzyl 4-methoxyphenyl ketone4'-Methoxy-2-phenylacetophenone

IUPAC Traditional name

1-(4-methoxyphenyl)-2-phenylethanone

Names and Identifiers

Registration numbers

CAS Number

PubChem CID

PubChem SID

MDL Number