Ropinirole Impurity 9

CAT: 1596-AR-R11346-02Size: 25 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-R11346-02Size:25 Units

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24/48H Stock Items & 2 to 6 Weeks non Stock Items.

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CAS Number

855382-76-2

Synonyms

2- (2-Methyl-3-nitrophenyl) ethan-1-ol

Molecular Formula

C9H11NO3

Molecular Weight

181.19

API Name

Ropinirole

Chemical Information

2-(2-Methyl-3-nitrophenyl)ethan-1-ol

CAS Number	855382-76-2
PubChem CID	11998857
IUPAC Name	2-(2-methyl-3-nitrophenyl)ethanol
Molecular Formula	C9H11NO3
Molecular Weight	181.19
XLogP	2
Topological Polar Surface Area	66.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Heavy Atom Count	13
Formal Charge	0
Complexity	178

SMILES

CC1=C(C=CC=C1[N+](=O)[O-])CCO

InChI

InChI=1S/C9H11NO3/c1-7-8(5-6-11)3-2-4-9(7)10(12)13/h2-4,11H,5-6H2,1H3

InChIKey

LBOLDCCWPUYOFS-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 855382-76-2

CID: 11998857

Formula: C9H11NO3

MW: 181.19

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	181.19
XLogP3	2
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	2
Exact Mass	181.07389321
Monoisotopic Mass	181.07389321
Topological Polar Surface Area	66.1 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	178
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-R11348-01	Ropinirole Impurity 11
AR-R09934-01	Ropinirole Cyclopentanylindone Impurity
AR-R01968-01	Ropinirole Cyclopentanylindone Impurity
AR-R11351-01	Ropinirole Impurity 14
AR-R11349-01	Ropinirole Impurity 12
AR-R11358-01	Ropinirole Impurity 6
AR-R11343-01	Ropinirole Impurity 7
AR-R11341-01	Ropinirole Impurity 1
AR-R11347-01	Ropinirole Impurity 10
AR-R11344-01	Ropinirole Impurity 3

Catalog	Name
RM-R161418-01	Ropinirole Impurity 18
RM-R161422-01	Ropinirole Impurity 22
RM-R161424-01	Ropinirole Impurity 24
RM-R161419-01	Ropinirole Impurity 19
RM-R161417-01	Ropinirole Impurity 17
RM-R161421-01	Ropinirole Impurity 21
RM-R161416-01	Ropinirole Impurity 16
RM-R161411-01	Ropinirole EP Impurity C; Propylidene ropinirole (USP)
RM-R161412-01	Ropinirole EP Impurity D (N-Despropyl Ropinirole)
RM-R161420-01	Ropinirole Impurity 20; USP Ropinirole methylene dimer