1-azabicyclo[2.2.2]octane-3-carbonitrile

Modify Date: 2024-01-14 17:39:27

1-azabicyclo[2.2.2]octane-3-carbonitrile Structure
1-azabicyclo[2.2.2]octane-3-carbonitrile structure
Common Name 1-azabicyclo[2.2.2]octane-3-carbonitrile
CAS Number 51627-76-0 Molecular Weight 136.19400
Density 1.08g/cm3 Boiling Point 248.8ºC at 760 mmHg
Molecular Formula C8H12N2 Melting Point N/A
MSDS N/A Flash Point 104.1ºC

 Names

Name 1-azabicyclo[2.2.2]octane-3-carbonitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.08g/cm3
Boiling Point 248.8ºC at 760 mmHg
Molecular Formula C8H12N2
Molecular Weight 136.19400
Flash Point 104.1ºC
Exact Mass 136.10000
PSA 27.03000
LogP 0.78968
Index of Refraction 1.532

 Synthetic Route

~99%

1-azabicyclo[2.2.2]octane-3-carbonitrile Structure

1-azabicyclo[2....

CAS#:51627-76-0

Literature: BAYER HEALTHCARE AG Patent: WO2005/12299 A1, 2005 ; Location in patent: Page/Page column 18 ;

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1-azabicyclo[2.2.2]octane-3-carbonitrile Structure

1-azabicyclo[2....

CAS#:51627-76-0

Literature: VERTEX PHARMACEUTICALS INCORPORATED; MORTIMORE, Michael; EVERITT, Simon; RUTHERFORD, Alistair; KNEGTEL, Ronald Patent: WO2013/43961 A1, 2013 ; Location in patent: Paragraph 00156 ; WO 2013/043961 A1

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1-azabicyclo[2.2.2]octane-3-carbonitrile Structure

1-azabicyclo[2....

CAS#:51627-76-0

Literature: Merck, Sharp and Dohme, Ltd. Patent: US5686463 A1, 1997 ;

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1-azabicyclo[2.2.2]octane-3-carbonitrile Structure

1-azabicyclo[2....

CAS#:51627-76-0

Literature: Saunders, John; Cassidy, Mark; Freedman, Stephen B.; Harley, Elizabeth A.; Iversen, Leslie L.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 4 p. 1128 - 1138

 Synonyms

quinuclidine-3-carbonitrile
RD-32