All Photos(1)

232882

Sigma-Aldrich

3,5-Bis(trifluoromethyl)benzoic acid

98%

Linear Formula:
(CF3)2C6H3CO2H
CAS Number:
Molecular Weight:
258.12
Beilstein:
2058600
EC Number:
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

98%

mp

142-143 °C (lit.)

SMILES string

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

InChI

1S/C9H4F6O2/c10-8(11,12)5-1-4(7(16)17)2-6(3-5)9(13,14)15/h1-3H,(H,16,17)

InChI key

HVFQJWGYVXKLTE-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Related Categories

General description

3,5-Bis(trifluoromethyl)benzoic acid is a significant metabolite formed during metabolism of 3,5-bis(trifluoromethyl)benzyl ether via oxidation.

Packaging

5, 25 g in glass bottle

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

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

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK Germany

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US),Eyeshields,Gloves

Certificate of Analysis

Certificate of Origin

3-Benzyloxy-2-phenylpiperidine NK1 antagonists: the influence of alpha methyl substitution.
Swain CJ, et al.
Bioorganic & Medicinal Chemistry Letters, 7(23), 2959-2962 (1997)

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