Quinuclidine

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Names

[ CAS No. ]:
100-76-5

[ Name ]:
Quinuclidine

[Synonym ]:
1,4-ETHYLENEPIPERIDINE
1-Azabicyclo(2.2.2)octane
EINECS 202-887-1
ABCO
MFCD00006690
UNII-XFX99FC5VI
Quinuclidine
1-Azabicyclo[2.2.2]octane
1,4-ethanopiperidine

Chemical & Physical Properties

[ Density]:
1.0±0.1 g/cm3

[ Boiling Point ]:
149.5±8.0 °C at 760 mmHg

[ Melting Point ]:
157-160 °C(lit.)

[ Molecular Formula ]:
C₇H₁₃N

[ Molecular Weight ]:
111.185

[ Flash Point ]:
36.5±15.3 °C

[ Exact Mass ]:
111.104797

[ PSA ]:
3.24000

[ LogP ]:
1.38

[ Vapour Pressure ]:
4.0±0.3 mmHg at 25°C

[ Index of Refraction ]:
1.513

MSDS

Click to get detail MSDS

Safety Information

[ Hazard Codes ]:
T

[ Risk Phrases ]:
R24/25;R38;R41

[ Safety Phrases ]:
S26-S36/37/39-S45

[ RIDADR ]:
UN 2811 6.1/PG 2

[ WGK Germany ]:
3

[ RTECS ]:
CL5594625

[ Packaging Group ]:
III

[ Hazard Class ]:
8

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

2-(4-Piperidinyl)ethanol
Piperidine, 4-ethyl-
3-Chloroquinuclidine hydrochloride
Quinuclidinium chloride
Carbon tetrachloride
4-Pyridineethanol
1-phenethylquinuclidin-1-ium
N-[2-(p-nitrophenyl)ethyl]quinuclidinium
1,5-dibromo-3-(2-bromoethyl)pentane

DownStream

4-ethvlpvridine
3-QUINUCLIDINONE
1-azabicyclo[2.2.2]octan-2-one
1-[2-chloro-1-(4-nitrophenyl)ethenyl]-4-nitrobenzene
Quinuclidinium chloride
1-dodecyl-1-azoniabicyclo[2.2.2]octane,bromide
quinuclidinyl radical
tert-Butanol
1-methyl-1-azoniabicyclo[2.2.2]octane,iodide
1-ethyl-1-azoniabicyclo[2.2.2]octane,iodide