4'-Chloro-2'-fluoroacetophenone

CAT: 0024-sc-323298ASize: 25 gDry Ice: NoHazardous: No

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CAT#:0024-sc-323298ASize:25 g

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CAS Number

175711-83-8

Chemical Information

1-(4-Chloro-2-fluorophenyl)ethan-1-one

CAS Number	175711-83-8
PubChem CID	15030552
IUPAC Name	1-(4-chloro-2-fluorophenyl)ethanone
Molecular Formula	C8H6ClFO
Molecular Weight	172.58
XLogP	2.3
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Heavy Atom Count	11
Formal Charge	0
Complexity	160

SMILES

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

InChI

InChI=1S/C8H6ClFO/c1-5(11)7-3-2-6(9)4-8(7)10/h2-4H,1H3

InChIKey

OIGMDNONQJGUCF-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 175711-83-8

CID: 15030552

Formula: C8H6ClFO

MW: 172.58

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	172.58
XLogP3	2.3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	1
Exact Mass	172.0091207
Monoisotopic Mass	172.0091207
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	160
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
sc-266244	2'-Chloro-4'-fluoroacetophenone
sc-230143	2-Chloro-4'-fluoroacetophenone
sc-267844	4'-Chloro-3'-fluoroacetophenone
sc-276577	3'-Chloro-4'-fluoroacetophenone
sc-229996	2-Bromo-3'-chloro-4'-fluoroacetophenone
sc-506957	5'-Chloro-2'-fluoroacetophenone
sc-266994	3'-Chloro-2'-fluoroacetophenone
sc-482256	2'-Chloro-5'-fluoroacetophenone
sc-281316	2'-Chloro-6'-fluoroacetophenone
sc-260324	2'-Bromo-4'-fluoroacetophenone

Catalog	Name
433927-01	4'-Chloro-2'-fluoroacetophenone
421063-01	2'-Chloro-4'-fluoroacetophenone
GTR19252671-01	3-Chloro-4-fluoroacetophenone
PC1818M-01	3'-Chloro-4'-fluoroacetophenone
PC302106-01	4'-Chloro-3'-fluoroacetophenone
415822-01	2-Bromo-3'-chloro-4'-fluoroacetophenone
PC905600-01	5’-Bromo-4’-chloro-2’-fluoroacetophenone
PC32796-01	4’-Bromo-3’-chloro-2’-fluoroacetophenone
PC52205-01	4-Bromo-2-chloro-3-fluoroacetophenone
PC57502-01	2'-Bromo-4'-chloro-5'-fluoroacetophenone