Lansoprazole Impurity 27

CAT: 1299-RM-L191653-01Size: 10 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-L191653-01Size:10 mg

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CAS Number

128430-66-0

Synonyms

2- (chloromethyl) -3-methyl-4- (2,2,2-trifluoroethoxy) pyridine

Molecular Formula

C9H9ClF3NO

Molecular Weight

239.62

Target Alternative Name

Lansoprazole

Product Name Synonym

2- (chloromethyl) -3-methyl-4- (2,2,2-trifluoroethoxy) pyridine

Chemical Information

2-(Chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine

CAS Number	128430-66-0
PubChem CID	689080
IUPAC Name	2-(chloromethyl)-3-methyl-4-(2,2,2-trifluoroethoxy)pyridine
Molecular Formula	C9H9ClF3NO
Molecular Weight	239.62
XLogP	2.7
Topological Polar Surface Area	22.1
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Heavy Atom Count	15
Formal Charge	0
Complexity	200

SMILES

CC1=C(C=CN=C1CCl)OCC(F)(F)F

InChI

InChI=1S/C9H9ClF3NO/c1-6-7(4-10)14-3-2-8(6)15-5-9(11,12)13/h2-3H,4-5H2,1H3

InChIKey

AENYCMZUDXQARW-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 128430-66-0

CID: 689080

Formula: C9H9ClF3NO

MW: 239.62

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	239.62
XLogP3	2.7
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	3
Exact Mass	239.0324761
Monoisotopic Mass	239.0324761
Topological Polar Surface Area	22.1 Å²
Heavy Atom Count	15
Formal Charge	0
Complexity	200
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-L191617-01	Lansoprazole Thioxo Impurity
RM-L191633-01	Lansoprazole Impurity 7
RM-L191655-01	Lansoprazole Impurity 29
RM-L191659-01	Lansoprazole Impurity 33
RM-L121929-01	Lansoprazole Impurity 3
RM-L191651-01	Lansoprazole Impurity 25
RM-L191644-01	Lansoprazole Impurity 18
RM-L191646-01	Lansoprazole Impurity 20
RM-L191637-01	Lansoprazole Impurity 11
RM-L121927-01	Lansoprazole Impurity 1

Catalog	Name
AR-L01150-01	Lansoprazole Thioxo Impurity
AR-L01158-01	Lansoprazole Dessulphur Impurity
AR-L01172-01	Lansoprazole Impurity 6
AR-L06558-01	Lansoprazole Impurity 21
AR-L06542-01	Lansoprazole Impurity 32
AR-L06541-01	Lansoprazole Impurity 31
AR-L06554-01	Lansoprazole Impurity 11
AR-L06555-01	Lansoprazole Impurity 12
AR-L06537-01	Lansoprazole Impurity 27
AR-L06526-01	Lansoprazole Impurity 2