Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino]

Modify Date: 2025-08-25 19:00:35

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure
Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] structure
Common Name Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino]
CAS Number 404-26-2 Molecular Weight 233.14400
Density 1.539g/cm3 Boiling Point 370ºC at 760mmHg
Molecular Formula C9H6F3NO3 Melting Point N/A
MSDS N/A Flash Point 177.5ºC

 Names

Name 4-[(2,2,2-trifluoroacetyl)amino]benzoic acid
Synonym More Synonyms

 Chemical & Physical Properties

Density 1.539g/cm3
Boiling Point 370ºC at 760mmHg
Molecular Formula C9H6F3NO3
Molecular Weight 233.14400
Flash Point 177.5ºC
Exact Mass 233.03000
PSA 66.40000
LogP 1.95860
Vapour Pressure 3.98E-06mmHg at 25°C
Index of Refraction 1.545
InChIKey TZDURDLECJWHJD-UHFFFAOYSA-N
SMILES O=C(O)c1ccc(NC(=O)C(F)(F)F)cc1

 Safety Information

HS Code 2924299090

 Synthetic Route

~97%

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure

Benzoic acid,4-...

CAS#:404-26-2

Literature: Daly; Padgett; Shamim Journal of Medicinal Chemistry, 1986 , vol. 29, # 8 p. 1520 - 1524

~97%

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure

Benzoic acid,4-...

CAS#:404-26-2

Literature: Steiner, Sandra; Li, Jim; Schoenfeld, Ryan Craig; Talamas, Francisco Xavier Patent: US2010/158860 A1, 2010 ; US 20100158860 A1

~%

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure

Benzoic acid,4-...

CAS#:404-26-2

Literature: Schallenberg; Calvin Journal of the American Chemical Society, 1955 , vol. 77, p. 2779,2782

~%

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure

Benzoic acid,4-...

CAS#:404-26-2

Literature: Jones, Paul; Villeneuve, Gerald B.; Fei, Chengpei; DeMarte, Josie; Haggarty, Allison J.; Nwe, Khin Than; Martin, Deborah A.; Lebuis, Anne-Marie; Finkelstein, Joshua M.; Gour-Salin, Barbara J.; Chan, Tak Hang; Leyland-Jones, Brian R. Journal of Medicinal Chemistry, 1998 , vol. 41, # 16 p. 3062 - 3077

~%

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure

Benzoic acid,4-...

CAS#:404-26-2

Literature: Emenike, Bright U.; Liu, Albert Tianxiang; Naveo, Elsy P.; Roberts, John D. Journal of Organic Chemistry, 2013 , vol. 78, # 23 p. 11765 - 11771

~%

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure

Benzoic acid,4-...

CAS#:404-26-2

Literature: Maunder, Peter; Finglas, Paul M.; Mallet, Anthony I.; Mellon, Fred A.; Aaqib Razzaque; Ridge, Brian; Vahteristo, Liisa; Witthoeft, Cornelia Journal of the Chemical Society - Perkin Transactions 1, 1999 , # 10 p. 1311 - 1323

~%

Benzoic acid,4-[(2,2,2-trifluoroacetyl)amino] Structure

Benzoic acid,4-...

CAS#:404-26-2

Literature: Maunder, Peter; Finglas, Paul M.; Mallet, Anthony I.; Mellon, Fred A.; Aaqib Razzaque; Ridge, Brian; Vahteristo, Liisa; Witthoeft, Cornelia Journal of the Chemical Society - Perkin Transactions 1, 1999 , # 10 p. 1311 - 1323

 Customs

HS Code 2924299090
Summary 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

 Bioassay

View more

Name: In vitro inhibitory activity against H1N9 strain of Influenza neuraminidase (membrane...
Source: ChEMBL
Target: Sialidase-3
External Id: CHEMBL751097
Name: Cell-based high throughput primary assay to identify activators of GPR151
Source: The Scripps Research Institute Molecular Screening Center
Target: RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id: GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
Name: AlphaScreen-based biochemical high throughput primary assay to identify activators of...
Source: The Scripps Research Institute Molecular Screening Center
Target: N/A
External Id: FBW7_ACT_ALPHA_1536_1X%ACT PRUN
Name: AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
Source: The Scripps Research Institute Molecular Screening Center
External Id: MITF_INH_Alpha_1536_1X%INH PRUN
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 Synonyms

N-trifluoroacetyl-4-aminobenzoic acid
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