2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid

Modify Date: 2024-01-09 15:09:37

2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid Structure
2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid structure
Common Name 2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid
CAS Number 209917-93-1 Molecular Weight 281.19000
Density N/A Boiling Point N/A
Molecular Formula C12H6F3N3O2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid

 Chemical & Physical Properties

Molecular Formula C12H6F3N3O2
Molecular Weight 281.19000
Exact Mass 281.04100
PSA 78.91000
LogP 2.46098

 Synthetic Route

~90%

2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid Structure

2-(3-cyanopheny...

CAS#:209917-93-1

Literature: Bristol-Myers Squibb Pharma Company Patent: EP946508 B1, 2009 ; Location in patent: Page/Page column 38 ;

~16%

2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid Structure

2-(3-cyanopheny...

CAS#:209917-93-1

Literature: AJINOMOTO CO., INC.; Matsumoto, Kayo; Sugiki, Masayuki; Yamada, Tatsuhiro; Noguchi, Misato; Takayanagi, Masaru; Takada, Atsushi; Nakagawa, Tadakiyo; Miyanaga, Wataru; Muronoi, Shin; Taniguchi, Shinya Patent: US2013/23563 A1, 2013 ; Location in patent: Paragraph 0516-0518 ;

~%

2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid Structure

2-(3-cyanopheny...

CAS#:209917-93-1

Literature: Bristol-Myers Squibb Pharma Company Patent: US6329527 B1, 2001 ;

~%

2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid Structure

2-(3-cyanopheny...

CAS#:209917-93-1

Literature: Pinto; Orwat; Wang; Fevig; Quan; Amparo; Cacciola; Rossi; Alexander; Smallwood; Luettgen; Liang; Aungst; Wright; Knabb; Wong; Wexler; Lam Journal of Medicinal Chemistry, 2001 , vol. 44, # 4 p. 566 - 578

~%

2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid Structure

2-(3-cyanopheny...

CAS#:209917-93-1

Literature: Pinto; Orwat; Wang; Fevig; Quan; Amparo; Cacciola; Rossi; Alexander; Smallwood; Luettgen; Liang; Aungst; Wright; Knabb; Wong; Wexler; Lam Journal of Medicinal Chemistry, 2001 , vol. 44, # 4 p. 566 - 578

~%

2-(3-cyanophenyl)-5-(trifluoromethyl)pyrazole-3-carboxylic acid Structure

2-(3-cyanopheny...

CAS#:209917-93-1

Literature: AJINOMOTO CO., INC.; Matsumoto, Kayo; Sugiki, Masayuki; Yamada, Tatsuhiro; Noguchi, Misato; Takayanagi, Masaru; Takada, Atsushi; Nakagawa, Tadakiyo; Miyanaga, Wataru; Muronoi, Shin; Taniguchi, Shinya Patent: US2013/23563 A1, 2013 ;