Home Other Building Blocks 2,4,6-Trifluorophenol

2,4,6-Trifluorophenol

CAS No.:
2268-17-9
Catalog Number:
AG003B4D
Molecular Formula:
C6H3F3O
Molecular Weight:
148.0826
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$25
- +
5g
95%
In Stock USA
United States
$75
- +
10g
95%
In Stock USA
United States
$138
- +
25g
95%
In Stock USA
United States
$275
- +
100g
95%
In Stock USA
United States
$850
- +
Product Description
Catalog Number:
AG003B4D
Chemical Name:
2,4,6-Trifluorophenol
CAS Number:
2268-17-9
Molecular Formula:
C6H3F3O
Molecular Weight:
148.0826
MDL Number:
MFCD00061216
IUPAC Name:
2,4,6-trifluorophenol
InChI:
InChI=1S/C6H3F3O/c7-3-1-4(8)6(10)5(9)2-3/h1-2,10H
InChI Key:
QQFWMPUXPLBWTG-UHFFFAOYSA-N
SMILES:
Fc1cc(F)c(c(c1)F)O
Properties
Complexity:
108  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
148.014g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
148.084g/mol
Monoisotopic Mass:
148.014g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9  
Literature
Title Journal
Revisiting the peroxidase oxidation of 2,4,6-trihalophenols: ESR detection of radical intermediates. Chemical research in toxicology 20111121
Probing the oxyferrous and catalytically active ferryl states of Amphitrite ornata dehaloperoxidase by cryoreduction and EPR/ENDOR spectroscopy. Detection of compound I. Journal of the American Chemical Society 20101027
Binding of phenol and differently halogenated phenols to dissolved humic matter as measured by NMR spectroscopy. Environmental science & technology 20090715
Different modes of binding of mono-, di-, and trihalogenated phenols to the hemoglobin dehaloperoxidase from Amphitrite ornata. Biochemistry 20090317
Degradation of 4-fluorophenol by Arthrobacter sp. strain IF1. Applied microbiology and biotechnology 20080301
Synthesis and evaluation of 3-aryloxymethyl-1,2-dimethylindole-4,7-diones as mechanism-based inhibitors of NAD(P)H:quinone oxidoreductase 1 (NQO1) activity. Journal of medicinal chemistry 20071115
Development and evaluation of an immunoassay for biological monitoring chlorophenols in urine as potential indicators of occupational exposure. Analytical chemistry 20020115
Properties