Flupentixol EP Impurity G

CAT: 1299-RM-F121607-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-F121607-01Size:10 mg

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CAS Number

1693-28-3

Synonyms

2- (trifluoromethyl) -9H-thioxanthen-9-one

Molecular Formula

C14H7F3OS

Molecular Weight

280.26

Target Alternative Name

Flupentixol

Product Name Synonym

2- (trifluoromethyl) -9H-thioxanthen-9-one

Chemical Information

2-(Trifluoromethyl)-9H-thioxanthen-9-one

CAS Number	1693-28-3
PubChem CID	74324
IUPAC Name	2-(trifluoromethyl)thioxanthen-9-one
Molecular Formula	C14H7F3OS
Molecular Weight	280.27
XLogP	4.9
Topological Polar Surface Area	42.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Heavy Atom Count	19
Formal Charge	0
Complexity	368

SMILES

C1=CC=C2C(=C1)C(=O)C3=C(S2)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C14H7F3OS/c15-14(16,17)8-5-6-12-10(7-8)13(18)9-3-1-2-4-11(9)19-12/h1-7H

InChIKey

NEWRXGDGZGIHIS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 1693-28-3

CID: 74324

Formula: C14H7F3OS

MW: 280.27

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	280.27
XLogP3	4.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	0
Exact Mass	280.01697050
Monoisotopic Mass	280.01697050
Topological Polar Surface Area	42.4 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	368
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
RM-F121601-01	Flupentixol EP Impurity A
RM-F121610-01	Flupentixol EP Impurity H
RM-F121611-01	Flupentixol EP Impurity I
RM-F121602-01	Flupentixol EP Impurity B
RM-F121603-01	Flupentixol EP Impurity C
RM-F121604-01	Flupentixol EP Impurity D
RM-F121605-01	Flupentixol EP Impurity E
RM-E192020-01	Escitalopram EP Impurity G; Citalopram EP Impurity G
RM-F121612-01	Flupentixol Impurity 12
RM-F121615-01	Flupentixol Impurity 15