3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-(2-(trifluor omethyl)phenyl)-2,7,7-trimethyl-, ethyl ester

Modify Date: 2024-02-06 06:52:42

3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-(2-(trifluor omethyl)phenyl)-2,7,7-trimethyl-, ethyl ester Structure
3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-(2-(trifluor omethyl)phenyl)-2,7,7-trimethyl-, ethyl ester structure
Common Name 3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-(2-(trifluor omethyl)phenyl)-2,7,7-trimethyl-, ethyl ester
CAS Number 78050-80-3 Molecular Weight 407.42600
Density 1.25g/cm3 Boiling Point 485.3ºC at 760 mmHg
Molecular Formula C22H24F3NO3 Melting Point N/A
MSDS N/A Flash Point 247.3ºC

 Names

Name ethyl 2,7,7-trimethyl-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,6,8-tetrahydroquinoline-3-carboxylate
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.25g/cm3
Boiling Point 485.3ºC at 760 mmHg
Molecular Formula C22H24F3NO3
Molecular Weight 407.42600
Flash Point 247.3ºC
Exact Mass 407.17100
PSA 55.40000
LogP 5.20130
Index of Refraction 1.54

 Synthetic Route

~84%

3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-(2-(trifluor omethyl)phenyl)-2,7,7-trimethyl-, ethyl ester Structure

3-Quinolinecarb...

CAS#:78050-80-3

Literature: Evans, Christopher G.; Jinwal, Umesh K.; Makley, Leah N.; Dickey, Chad A.; Gestwicki, Jason E. Chemical Communications, 2011 , vol. 47, # 1 p. 529 - 531

~58%

3-Quinolinecarboxylic acid, 1,4,5,6,7,8-hexahydro-5-oxo-4-(2-(trifluor omethyl)phenyl)-2,7,7-trimethyl-, ethyl ester Structure

3-Quinolinecarb...

CAS#:78050-80-3

Literature: Vitolinya, R. O.; Stankevich, E. I.; Grinshtein, E. E.; Dreimane, A. Ya. Pharmaceutical Chemistry Journal, 1981 , vol. 15, # 1 p. 17 - 19 Khimiko-Farmatsevticheskii Zhurnal, 1981 , vol. 15, # 1 p. 39 - 42

 Synonyms

5-Oxo-1H-3,4,5,6-tetrahydro-2,6-methano-2-benzazocin
5-Oxo-2,6-methano-3,4,5,6-tetrahydro-1H-<2>benzazocin
5-Oxo-2,6-methano-2-benzazocine