Bupropion Morpholinol Impurity

CAT: 1299-RM-B161613-02Size: 25 mgDry Ice: NoHazardous: No

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CAT#:1299-RM-B161613-02Size:25 mg

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CAS Number

357399-43-0

Synonyms

2- (3-Chlorophenyl) -3,5,5-trimethyl-2-morpholinol

Molecular Formula

C13H18ClNO2

Molecular Weight

255.74

Target Alternative Name

Bupropion

Product Name Synonym

2- (3-Chlorophenyl) -3,5,5-trimethyl-2-morpholinol

Chemical Information

2-(3-Chlorophenyl)-3,5,5-trimethyl-2-morpholinol

CAS Number	357399-43-0
PubChem CID	9837966
IUPAC Name	2-(3-chlorophenyl)-3,5,5-trimethylmorpholin-2-ol
Molecular Formula	C13H18ClNO2
Molecular Weight	255.74
XLogP	1.9
Topological Polar Surface Area	41.5
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Heavy Atom Count	17
Formal Charge	0
Complexity	285

SMILES

CC1C(OCC(N1)(C)C)(C2=CC(=CC=C2)Cl)O

InChI

InChI=1S/C13H18ClNO2/c1-9-13(16,17-8-12(2,3)15-9)10-5-4-6-11(14)7-10/h4-7,9,15-16H,8H2,1-3H3

InChIKey

RCOBKSKAZMVBHT-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 357399-43-0

CID: 9837966

Formula: C13H18ClNO2

MW: 255.74

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	255.74
XLogP3	1.9
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	255.1026065
Monoisotopic Mass	255.1026065
Topological Polar Surface Area	41.5 Å²
Heavy Atom Count	17
Formal Charge	0
Complexity	285
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	2
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
RM-B161615-01	Bupropion Morpholinol (2R,3R) -Isomer
RM-B161633-01	Bupropion Impurity 33
RM-B161637-01	Bupropion Impurity 37
RM-B161632-01	Bupropion Impurity 32
RM-B161620-01	Bupropion Impurity T
RM-B161629-01	Bupropion Impurity 29
RM-B161634-01	Bupropion Impurity 34
RM-B161636-01	Bupropion Impurity 36
RM-B161635-01	Bupropion Impurity 35
RM-B161628-01	Bupropion Impurity 28

Catalog	Name
HY-12766	Bupropion morpholinol
AR-B02234-01	Bupropion Morpholinol (Hydroxy Bupropion)
CS-O-06114	Hydroxy Bupropion (Bupropion Morpholinol)
TMIH-0129-01	Bupropion Morpholinol-d8
MBS3846015-01	Bupropion morpholinol D6
HY-12766S-01	Bupropion morpholinol-d6
A21587-10	Bupropion morpholinol D6 10mg
A21587-5	Bupropion morpholinol D6 5mg
A21587-1	Bupropion morpholinol D6 1mg
AR-B02247-01	Bupropion Impurity