CAS 51336-94-8|2-Chloro-2',4'-difluoroacetophenone|2,4-Difluorophenacyl chloride 98%|2-chloro-1-(2,4-difluorophenyl)ethanone|2-chloro-1-(2,4-difluorophenyl)ethan-1-one|2-Chloro-2′,4′-difluoroaceto...

General Information

Structure

Molecular Formula

C₈H₅ClF₂O

Molecular Mass

190.5745064

Exact Mass

189.9996989

Charge

InChI

InChI=1S/C8H5ClF2O/c9-4-8(12)6-2-1-5(10)3-7(6)11/h1-3H,4H2

InChIKey

UENGBOCGGKLVJJ-UHFFFAOYSA-N

Canonic Smiles

ClCC(=O)c1ccc(cc1F)F

Isomeric Smiles

Fc1c(ccc(c1)F)C(=O)CCl

Calculated Properties

JChem

Acid pKa

14.617691

H Acceptors

H Donor

LogD (pH = 5.5)

2.353641

LogD (pH = 7.4)

2.353641

Log P

2.353641

Molar Refractivity

41.6468

Polarizability

15.449715

Polar Surface Area

17.07

Rotatable Bonds

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Synonyms

2-Chloro-2',4'-difluoroacetophenone2,4-Difluorophenacyl chloride 98%2-Chloro-2′,4′-difluoroacetophenoneα-Chloro-2,4-difluoroacetophenone2-Chloro-1-(2,4-difluorophenyl)ethanone2-Chloro-2',4'-difluoroacetophenone2-氯-2′,4′-二氟苯乙酮Chloromethyl 2,4-Difluorophenyl Ketone2-氯-2',4'-二氟苯乙酮2-Chloro-2',4'-difluoroacetophenone2,4-Difluorophenacyl chloride2-chloro-1-(2,4-difluorophenyl)ethanone

IUPAC Traditional name

2-chloro-1-(2,4-difluorophenyl)ethanone

IUPAC name

2-chloro-1-(2,4-difluorophenyl)ethan-1-one

Names and Identifiers

Registration numbers

MDL Number

MFCD00013252

CAS Number

51336-94-8

PubChem SID

24856475162079730