3-Fluoro-4-(trifluoromethoxy)phenol

Basic Information

View in Editor

CAS Number

177596-38-2

Molecular Formula

C7H4F4O2

Molecular Weight

196.1 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Specialty Chemicals UV Stabilizers

Agricultural Chemicals Pesticides Herbicides

Electronic Chemicals Semiconductor Materials Etchants

Basic Physical Properties

Boiling Point

196.9°Cat760mmHg

Density

1.48

Flash Point

99.2°C

Refractive Index

1.4340 to 1.4380

SMILES

View in Editor

C1=CC(=C(C=C1O)F)OC(F)(F)F

InChI

InChI=1S/C7H4F4O2/c8-5-3-4(12)1-2-6(5)13-7(9,10)11/h1-3,12H

InChIKey

UTFSPWRTXCDUIJ-UHFFFAOYSA-N

LogP

2.4298999999999995

Topological Polar Surface Area

29.46 Å²

Hydrogen Bond Donor/Acceptor

1 / 2

Complexity

170

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Sensitiveness

对空气敏感

Synonyms & References

English

Phenol, 3-fluoro-4-(trifluoromethoxy)-
MFCD06660342
SCHEMBL1253983
AKOS015956781
5-(alpha-Carboxyethyl)-2-Phenylthio-PhenylaceticAcid
AM62297
3-Fluoro-4-(trifluoromethoxy)phenol
3-FLUORO-4-TRIFLUOROMETHOXYPHENOL
F1009
DS-14291
177596-38-2
A812278
3-Fluoro-4-(trifluoromethoxy)phenol, AldrichCPR
DTXSID90382605
3-fluoro-4-trifluromethoxyphenol
SY050858
CS-W010607
3-fluoranyl-4-(trifluoromethyloxy)phenol
EN300-7397706
C7H4F4O2
3-fluoro-4-trifluoromethoxy phenol
JRD-1989
EOS-61875
3-fluoro-4-(trifluoromehoxy)phenol
1-Fluoro-5-hydroxy-2-(trifluoromethoxy)benzene
UTFSPWRTXCDUIJ-UHFFFAOYSA-N
SBB091956
9320AA
PC10448
FCH1118423
3-fluoranyl-4-(trifluoromethylo

MDL Number

MFCD06660342

FAQ

What are the physical and chemical properties of 3-Fluoro-4-(trifluoromethoxy)phenol (CAS: 177596-38-2)?

3-Fluoro-4-(trifluoromethoxy)phenol (CAS: 177596-38-2) is a crystalline solid with a molecular weight of approximately 264.07 g/mol. It has a low solubility in water but is more soluble in organic solvents. Chemically, it is relatively stable but can undergo substitution reactions. It has a strong absorption in the UV/Vis region due to the presence of a fluoro-substituted aromatic ring.

How is 3-Fluoro-4-(trifluoromethoxy)phenol (CAS: 177596-38-2) typically synthesized?

3-Fluoro-4-(trifluoromethoxy)phenol is typically synthesized through the chlorination of 4-(trifluoromethoxy)phenol followed by a substitution reaction with fluoroamine. Commonly used catalysts include bases like sodium hydride. The reaction yields a high purity product with good selectivity and yield.

What industries use 3-Fluoro-4-(trifluoromethoxy)phenol (CAS: 177596-38-2)?

3-Fluoro-4-(trifluoromethoxy)phenol (CAS: 177596-38-2) is primarily used in pharmaceuticals for the synthesis of active pharmaceutical ingredients (APIs). It is also utilized in the production of sensors and some specialty chemicals. Its applications in semiconductor manufacturing and polymer synthesis are less common but still relevant.

What precautions should be taken when handling 3-Fluoro-4-(trifluoromethoxy)phenol (CAS: 177596-38-2)?

When handling 3-Fluoro-4-(trifluoromethoxy)phenol (CAS: 177596-38-2), always wear appropriate personal protective equipment (PPE) including gloves, goggles, and a lab coat. Work in a well-ventilated area or fume hood to prevent inhalation. Spills should be cleaned up using appropriate absorbents, and the area should be well-ventilated. Always check the Material Safety Data Sheet (MSDS) or SDS for detailed safety information.