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5746-86-1

5746-86-1 structural image
Product Name: 3-(2-Pyrrolidinyl)pyridine
Formula: C9H12N2
Synonyms: (±)-Nornicotine;2-(3-Pyridyl)pyrrolidine;3-(2-Pyrrolidinyl)pyridine
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CHEMICAL AND PHYSICAL PROPERTIES

Physical Description Hygroscopic liquid; Develops a mild amine odor; [Merck Index] Colorless or pale yellow liquid; Hygroscopic; [Alfa Aesar MSDS]
Color/Form Hygroscopic, somewhat viscous liquid
Odor Develops a slight amine odor, less pungent than that of nicotine
Boiling Point 260 °C
Solubility Miscible in water; Very soluble in alcohol, chloroform, ether, petr ether, kerosene, oils
Density 1.0737 at 20 °C/4 °C
Vapor Pressure 0.0097 [mmHg]
LogP log Kow = 0.17
Optical Rotation Specific optical rotation: -89 degrees at 22 °C
Decomposition When heated to decomposition it emits very toxic fumes of /oxides of nitrogen and hydrochloric acid/.
Refractive Index Index of refraction: 1.5378 at 20 °C/D
Kovats Retention Index 1435.4
Other Experimental Properties Hardly volatile with steam
Chemical Classes Biological Agents -> Plant Toxins

SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07
GHS Hazard Statements H315:Skin corrosion/irritation
H319:Serious eye damage/eye irritation
H335:Specific target organ toxicity, single exposure;Respiratory tract irritation
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312:IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

COMPUTED DESCRIPTORS

Molecular Weight 148.20 g/mol
XLogP3 0.2
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 148.100048391 g/mol
Monoisotopic Mass 148.100048391 g/mol
Topological Polar Surface Area 24.9 Ų
Heavy Atom Count 11
Formal Charge 0
Complexity 125
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

Nornicotine is a natural product found in Nicotiana cavicola, Nicotiana benavidesii, and other organisms with data available.