4'-Chloro-2- (4-fluorophenyl) acetophenone

CAT: 0127-PC421014-01Size: 250 mgDry Ice: NoHazardous: No

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CAT#:0127-PC421014-01Size:250 mg

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CAS Number

126866-15-7

Synonyms

1- (4-Chlorophenyl) -2- (4-fluorophenyl) ethanone

MDL Number

MFCD02063016

Purity

95%

Smiles

Fc1ccc(CC(=O)c2ccc(Cl)cc2)cc1

Chemical Information

1-(4-Chlorophenyl)-2-(4-fluorophenyl)ethanone

CAS Number	126866-15-7
PubChem CID	720731
IUPAC Name	1-(4-chlorophenyl)-2-(4-fluorophenyl)ethanone
Molecular Formula	C14H10ClFO
Molecular Weight	248.68
XLogP	3.9
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Heavy Atom Count	17
Formal Charge	0
Complexity	253

SMILES

C1=CC(=CC=C1CC(=O)C2=CC=C(C=C2)Cl)F

InChI

InChI=1S/C14H10ClFO/c15-12-5-3-11(4-6-12)14(17)9-10-1-7-13(16)8-2-10/h1-8H,9H2

InChIKey

DEWHNPKDNJHLIN-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 126866-15-7

CID: 720731

Formula: C14H10ClFO

MW: 248.68

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	248.68
XLogP3	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	3
Exact Mass	248.0404208
Monoisotopic Mass	248.0404208
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	253
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
PC421018	2- (4-Fluorophenyl) acetophenone
PC421013	4'-Fluoro-2- (4-fluorophenyl) acetophenone
PC421010	2',4'-Dichloro-2- (4-fluorophenyl) acetophenone
PC53280-01	2'-Chloro-4'- (difluoromethoxy) acetophenone
PC53279	2'-Chloro-4'- (trifluoromethoxy) acetophenone
PC421011-01	3'-Fluoro-2- (4-fluorophenyl) acetophenone
PC303395-01	4'-Chloro-2'- (trifluoromethyl) acetophenone
OR9494-01	4'-Chloro-2- (methylsulphonyl) acetophenone
OR314001	4'-Chloro-2- (2,4-dichlorophenyl) acetophenone
PC421001-01	4'-Chloro-2- (3,4-difluorophenyl) acetophenone

Catalog	Name
sc-506590	4'-Chloro-2- (4-fluorophenyl) acetophenone
sc-506669	4'-Fluoro-2- (4-fluorophenyl) acetophenone
sc-506586	2',4'-Dichloro-2- (4-fluorophenyl) acetophenone
sc-323283A	4'- (2-Chloro-4-fluorophenoxy) acetophenone
sc-506585	2'-Chloro-4'- (trifluoromethoxy) acetophenone
sc-506587	4'-Chloro-2- (2,4-dichlorophenyl) acetophenone
029315-01	2-Bromo-4 '-Chloro Acetophenone
sc-506565	4'-Chloro-2- (3,4-difluorophenyl) acetophenone
415737-01	2-Bromo-2'-chloro-4'- (4-chlorophenoxy) acetophenone
TRC-B679145-2.5G	2-Bromo-2'-chloro-4'-(4-chlorophenoxy)acetophenone