Risperidone Difluoro Acetyl Impurity

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CAT#:1596-AR-R11038-05Size:150

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CAS Number

84162-82-3

Synonyms

4- (2,4-Difluorobenzoyl) -N-acetylpiperidine

Molecular Formula

C14H15F2NO2

Molecular Weight

267.28

API Name

Risperidone

Chemical Information

1-Acetyl-4-(2',4'-difluorobenzoyl)piperidine

CAS Number	84162-82-3
PubChem CID	2740707
IUPAC Name	1-[4-(2,4-difluorobenzoyl)piperidin-1-yl]ethanone
Molecular Formula	C14H15F2NO2
Molecular Weight	267.27
XLogP	1.8
Topological Polar Surface Area	37.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Heavy Atom Count	19
Formal Charge	0
Complexity	353

SMILES

CC(=O)N1CCC(CC1)C(=O)C2=C(C=C(C=C2)F)F

InChI

InChI=1S/C14H15F2NO2/c1-9(18)17-6-4-10(5-7-17)14(19)12-3-2-11(15)8-13(12)16/h2-3,8,10H,4-7H2,1H3

InChIKey

UGPWQEIGJWVJDR-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 84162-82-3

CID: 2740707

Formula: C14H15F2NO2

MW: 267.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	267.27
XLogP3	1.8
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	2
Exact Mass	267.10708505
Monoisotopic Mass	267.10708505
Topological Polar Surface Area	37.4 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	353
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
AR-R11069-01	Risperidone Impurity 30 (4-Fluoro Risperidone)
AR-R11045-01	Risperidone Impurity 19
AR-R11050-01	Risperidone Impurity 24
AR-R11054-01	Risperidone Impurity 28
AR-R11061-01	Risperidone Impurity 36
AR-R01712-01	Risperidone Impurity 2
AR-R11041-01	Risperidone Impurity 14
AR-R11043-01	Risperidone Impurity 17
AR-R11044-01	Risperidone Impurity 18
AR-R11057-01	Risperidone Impurity 32

Catalog	Name
RM-R191621-01	Risperidone Difluoro Acetyl Impurity
50R-R68808	Risperidone (impurity)
sc-219977	Risperidone Impurity
RM-R191614-01	Risperidone Impurity 14 (Bicyclo Risperidone)
MBS6040676-01	Risperidone Pyrimidinone-N-oxide (Risperidone impurity)
WDC60386-01	Risperidone carboxylate impurity
RM-R191642-01	Risperidone Impurity 42
RM-R191646-01	Risperidone Impurity 46
RM-R191601-01	Risperidone EP Impurity A
RM-R191633-01	Risperidone Impurity 33