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β-Nornicotyrine

CAT: 0013-GTR19266217-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19266217-01Size:10 mg
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Description
β-Nornicotyrine (3- (1H-Pyrrol-2-yl) pyridine) is an alkaloid identified in Nicotiana species (such as tobacco) and is utilized in the study of neurological disorders.
CAS Number
494-98-4
Smiles
N=1C=CC=C (C1) C2=CC=CN2
Molecular Formula
C9H8N2
Molecular Weight
144.17
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Nornicotyrine
CAS Number494-98-4
PubChem CID68125
IUPAC Name3-(1H-pyrrol-2-yl)pyridine
Molecular FormulaC9H8N2
Molecular Weight144.17
XLogP1.3
Topological Polar Surface Area28.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Heavy Atom Count11
Formal Charge0
Complexity125
SMILES
C1=CC(=CN=C1)C2=CC=CN2
InChI
InChI=1S/C9H8N2/c1-3-8(7-10-5-1)9-4-2-6-11-9/h1-7,11H
InChIKey
CBTWKRLUNDZXIF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nornicotyrine
CAS: 494-98-4
CID: 68125
Formula: C9H8N2
MW: 144.17
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight144.17
XLogP31.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count1
Rotatable Bond Count1
Exact Mass144.068748264
Monoisotopic Mass144.068748264
Topological Polar Surface Area28.7 Ų
Heavy Atom Count11
Formal Charge0
Complexity125
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
TN11422-01β-Nornicotyrine
TRC-N825000-10MGBeta-Nornicotyrine
N4000-40GB-Nornicotyrine (2- (3-Pyridyl) pyrrole)
MBS6090038-01b-Nornicotyrine (2-(3-Pyridyl)pyrrole)

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