Skip to Content
MilliporeSigma
All Photos(2)

Documents

156035

Sigma-Aldrich

3-(Trifluoromethyl)phenol

99%

Synonym(s):

α,α,α-Trifluoro-m-cresol, 3-Hydroxybenzotrifluoride

Sign Into View Organizational & Contract Pricing
All Photos(2)

About This Item

Linear Formula:
CF3C6H4OH
CAS Number:
98-17-9
Molecular Weight:
162.11
Beilstein/REAXYS Number:
2045663
EC Number:
202-645-5
MDL number:
MFCD00002299
UNSPSC Code:
12352100
PubChem Substance ID:
24849588
NACRES:
NA.22

vapor pressure

0.56 mmHg ( 40 °C)

Quality Level

100

assay

99%

form

liquid

refractive index

n20/D 1.458 (lit.)

bp

178-179 °C (lit.)

mp

−2-−1.8 °C (lit.)

density

1.333 g/mL at 25 °C (lit.)

SMILES string

Oc1cccc(c1)C(F)(F)F

InChI

1S/C7H5F3O/c8-7(9,10)5-2-1-3-6(11)4-5/h1-4,11H

InChI key

UGEJOEBBMPOJMT-UHFFFAOYSA-N

Looking for similar products? Visit Product Comparison Guide

Related Categories

Application

3-(Trifluoromethyl)phenol (3-Hydroxybenzotrifluoride) was used in the preparation of travoprost (antiglaucoma agent).

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

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

target_organs

Respiratory system

wgk_germany

WGK 3

flash_point_f

closed cup

flash_point_c

closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

Already Own This Product?

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

Visit the Document Library

Customers Also Viewed

Slide 1 of 4

1 of 4

3-(Trifluoromethyl)aniline ≥99%

Sigma-Aldrich

A41801

3-(Trifluoromethyl)aniline

3-Iodobenzotrifluoride 98%

Sigma-Aldrich

206563

3-Iodobenzotrifluoride

3,5-Difluorophenol 99%

Sigma-Aldrich

197572

3,5-Difluorophenol

2-Chloropyridine-3-carboxylic acid 99%

Sigma-Aldrich

150339

2-Chloropyridine-3-carboxylic acid

Boulton LT, et al.
Organic Process Research & Development, 6(2), 138-145 (2002)
Akira Ohashi et al.
Talanta, 146, 789-794 (2015-12-24)
The solubilities of several cobalt(III) chelates (CoL3) with in supercritical carbon dioxide (SC-CO2) were investigated in the presence of fluorine- and trifluoromethyl-substituted phenols (PhOH) using UV-vis spectrophotometry. Solubility enhancement of CoL3 complexes in SC-CO2 was accomplished by adding PhOH. The
The many roles for fluorine in medicinal chemistry.
William K Hagmann
Journal of medicinal chemistry, 51(15), 4359-4369 (2008-06-24)

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