3-(1-Naphthyl)-3-oxopropanenitrile

Modify Date: 2024-01-18 19:09:35

3-(1-Naphthyl)-3-oxopropanenitrile Structure
3-(1-Naphthyl)-3-oxopropanenitrile structure
Common Name 3-(1-Naphthyl)-3-oxopropanenitrile
CAS Number 39528-57-9 Molecular Weight 195.217
Density 1.2±0.1 g/cm3 Boiling Point 405.0±28.0 °C at 760 mmHg
Molecular Formula C13H9NO Melting Point 90-97 °C
MSDS N/A Flash Point 198.7±24.0 °C

 Names

Name 3-naphthalen-1-yl-3-oxopropanenitrile
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.2±0.1 g/cm3
Boiling Point 405.0±28.0 °C at 760 mmHg
Melting Point 90-97 °C
Molecular Formula C13H9NO
Molecular Weight 195.217
Flash Point 198.7±24.0 °C
Exact Mass 195.068420
PSA 40.86000
LogP 2.20
Vapour Pressure 0.0±0.9 mmHg at 25°C
Index of Refraction 1.630

 Safety Information

Hazard Codes Xi

 Synthetic Route

~74%

3-(1-Naphthyl)-3-oxopropanenitrile Structure

3-(1-Naphthyl)-...

CAS#:39528-57-9

Literature: Millennium Pharmaceuticals, Inc.; Afroze, Roushan; Bharathan, Indu T.; Ciavarri, Jeffrey P.; Fleming, Paul E.; Gaulin, Jeffrey L.; Girard, Mario; Langston, Steven P.; Soucy, Francois; Wong, Tzu-Tshin; Ye, Yingchun Patent: US2013/217682 A1, 2013 ; Location in patent: Paragraph 0269; 0270 ;

~80%

3-(1-Naphthyl)-3-oxopropanenitrile Structure

3-(1-Naphthyl)-...

CAS#:39528-57-9

Literature: Baraldi, Pier Giovanni; Romagnoli, Romeo; Pavani, Maria Giovanna; Del Carmen Nunez, Maria; Tabrizi, Mojgan Aghazadeh; Shryock, John C.; Leung, Edward; Moorman, Allan R.; Uluoglu, Canan; Iannotta, Valeria; Merighi, Stefania; Borea, Pier Andrea Journal of Medicinal Chemistry, 2003 , vol. 46, # 5 p. 794 - 809

~72%

3-(1-Naphthyl)-3-oxopropanenitrile Structure

3-(1-Naphthyl)-...

CAS#:39528-57-9

Literature: Yoo, Byung Woo; Hwang, Sun Kyun; Kim, Dong Yoon; Choi, Jin Woo; Ko, Jae Jung; Choi, Kyung Il; Kim, Joong Hyup Tetrahedron Letters, 2002 , vol. 43, # 27 p. 4813 - 4816

~%

3-(1-Naphthyl)-3-oxopropanenitrile Structure

3-(1-Naphthyl)-...

CAS#:39528-57-9

Literature: Long Journal of the American Chemical Society, 1947 , vol. 69, p. 990,993

~%

3-(1-Naphthyl)-3-oxopropanenitrile Structure

3-(1-Naphthyl)-...

CAS#:39528-57-9

Literature: I.G. Farbenind. Patent: DE701657 , 1933 ; DRP/DRBP Org.Chem.

~%

3-(1-Naphthyl)-3-oxopropanenitrile Structure

3-(1-Naphthyl)-...

CAS#:39528-57-9

Literature: Bayer Patent: CH557384DE2302273 , 19741974 ; Chem.Abstr., 1974 , vol. 81, # 120280

 Synonyms

3-Oxo-3-(naphthyl-(1))-propionsaeure-nitril
1-Naphthoylacetonitrile
1-Naphthalenepropanenitrile,b-oxo
2-(naphthalen-1-carbonyl)acetonitrile
3-[1]naphthyl-3-oxo-propionitrile
3-[1]Naphthyl-3-oxo-propionitril
2-(naphthalene-1-carbonyl)acetonitrile
3-(1-Naphthyl)-3-oxopropanenitrile
3-Naphthalen-1-yl-3-oxo-propionitrile
1-Naphthalenepropanenitrile, β-oxo-