Haloperidol Impurity 7

CAT: 1596-AR-H07392-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-H07392-02Size:25 Units

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CAS Number

2823-19-0

Synonyms

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

Molecular Formula

C10H10ClFO

Molecular Weight

200.64

API Name

Haloperidol

Chemical Information

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

CAS Number	2823-19-0
PubChem CID	18399926
IUPAC Name	4-chloro-1-(2-fluorophenyl)butan-1-one
Molecular Formula	C10H10ClFO
Molecular Weight	200.64
XLogP	2.6
Topological Polar Surface Area	17.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Heavy Atom Count	13
Formal Charge	0
Complexity	172

SMILES

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

InChI

InChI=1S/C10H10ClFO/c11-7-3-6-10(13)8-4-1-2-5-9(8)12/h1-2,4-5H,3,6-7H2

InChIKey

VOCPYEWBWOAVGP-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2823-19-0

CID: 18399926

Formula: C10H10ClFO

MW: 200.64

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	200.64
XLogP3	2.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	4
Exact Mass	200.0404208
Monoisotopic Mass	200.0404208
Topological Polar Surface Area	17.1 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	172
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-211217	Dechloro Haloperidol (Haloperidol Impurity B)
RM-H121600-01	Haloperidol; Haloperidol Decanoate EP Impurity G
RM-H121610-01	Haloperidol Impurity 10
RM-H121611-01	Haloperidol Impurity 11
RM-H121614-01	Haloperidol Impurity 14
RM-H121615-01	Haloperidol Impurity 15
RM-H121637-01	Haloperidol Impurity 37
RM-H121643-01	Haloperidol Impurity 43
RM-H121644-01	Haloperidol Impurity 44
RM-H121661-01	Haloperidol Impurity 61