Skip to Content
Merck
All Photos(1)

Key Documents

View All Documentation

455326

Sigma-Aldrich

3-Fluoro-5-(trifluoromethyl)benzoic acid

98%

Sign Into View Organizational & Contract Pricing
All Photos(1)

About This Item

Linear Formula:
FC6H3(CF3)CO2H
CAS Number:
161622-05-5
Molecular Weight:
208.11
MDL number:
MFCD00061293
UNSPSC Code:
12352100
PubChem Substance ID:
24869055
NACRES:
NA.22

Quality Level

100

Assay

98%

mp

104-108 °C (lit.)

functional group

carboxylic acid
fluoro

SMILES string

OC(=O)c1cc(F)cc(c1)C(F)(F)F

InChI

1S/C8H4F4O2/c9-6-2-4(7(13)14)1-5(3-6)8(10,11)12/h1-3H,(H,13,14)

InChI key

NSGKIIGVPBTOBF-UHFFFAOYSA-N

Pictograms

Exclamation mark
GHS07

Signal Word

Warning

Hazard Statements

H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number
STBJ9979
STBF3046V
STBD7710V
S47682V
S47682

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Marco Schaudt et al.
Bioorganic & medicinal chemistry letters, 20(3), 1225-1228 (2009-12-18)
The synthesis and SAR of two series of bradykinin B(1) receptor antagonists is described. The benzamide moiety proved to be a suitable replacement for the aryl ester functionality of biaryl based antagonists. In addition, it was found that semicarbazides can

Our team of scientists has experience in all areas of research including Life Science, Material Science, Chemical Synthesis, Chromatography, Analytical and many others.

Contact Technical Service