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3-Chlorophenol

CAS No.:
108-43-0
Catalog Number:
AG0037ZQ
Molecular Formula:
C6H5ClO
Molecular Weight:
128.5563
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
97%
In Stock USA
United States
$25
- +
100g
97%
In Stock USA
United States
$63
- +
500g
97%
In Stock USA
United States
$188
- +
Product Description
Catalog Number:
AG0037ZQ
Chemical Name:
3-Chlorophenol
CAS Number:
108-43-0
Molecular Formula:
C6H5ClO
Molecular Weight:
128.5563
MDL Number:
MFCD00048654
IUPAC Name:
3-chlorophenol
InChI:
InChI=1S/C6H5ClO/c7-5-2-1-3-6(8)4-5/h1-4,8H
InChI Key:
HORNXRXVQWOLPJ-UHFFFAOYSA-N
SMILES:
Oc1cccc(c1)Cl
EC Number:
203-582-6
UNII:
Z2Z7M2FTAD
NSC Number:
59700
RTECS Number:
SK2450000
UN Number:
2020
Properties
Complexity:
74.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
128.003g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
128.555g/mol
Monoisotopic Mass:
128.003g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
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Polyphasic characterization of two microbial consortia with wide dechlorination spectra for chlorophenols. Journal of bioscience and bioengineering 20121101
Role of iron species in the photo-transformation of phenol in artificial and natural seawater. The Science of the total environment 20120601
Marinopyrrole derivatives as potential antibiotic agents against methicillin-resistant Staphylococcus aureus (I). Marine drugs 20120401
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Decomposition of 3-chlorophenol on nitrogen modified TiO2 photocatalysts. Journal of hazardous materials 20120215
4-Chloro-2-hy-droxy-N-(4-methyl-phen-yl)benzamide. Acta crystallographica. Section E, Structure reports online 20120201
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Cloning and characterisation of a novel 2,4-dichlorophenol hydroxylase from a metagenomic library derived from polychlorinated biphenyl-contaminated soil. Biotechnology letters 20110601
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Stir membrane liquid-liquid microextraction. Journal of chromatography. A 20110218
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Mass balance and kinetic analysis of anaerobic microbial dechlorination of pentachlorophenol in a continuous flow column. Journal of bioscience and bioengineering 20100901
Dechlorination of pentachlorophenol using nanoscale Fe/Ni particles: role of nano-Ni and its size effect. Journal of hazardous materials 20100815
Reductive dechlorination of chlorophenols in estuarine sediments of Lake Shinji and Lake Nakaumi. Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20100701
Enhanced chlorophenol sorption of soils by rice-straw-ash amendment. Journal of hazardous materials 20100515
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Transformation of Triclosan by Fe(III)-saturated montmorillonite. Environmental science & technology 20100115
The bromination kinetics of phenolic compounds in aqueous solution. Journal of hazardous materials 20091030
[Degradation of 3-chlorophenol in aqueous solution by combined process of gamma-radiation and H2O2]. Huan jing ke xue= Huanjing kexue 20091015
Potential of Penicillium species in the bioremediation field. International journal of environmental research and public health 20090401
Detection of phenolic compounds using impedance spectroscopy measurements. Bioprocess and biosystems engineering 20090101
Use of Nafion as a membrane separator in membrane introduction of mass spectrometry. European journal of mass spectrometry (Chichester, England) 20090101
Complexation of phenols and thiophenol by phosphine oxides and phosphates. Extraction, isothermal titration calorimetry, and ab initio calculations. The journal of physical chemistry. A 20081120
[Characteristics of 4-chlorophenol degradation by a soil bacterium Acinetobacter sp]. Huan jing ke xue= Huanjing kexue 20081101
Application of principal component-artificial neural network models for simultaneous determination of phenolic compounds by a kinetic spectrophotometric method. Journal of hazardous materials 20080830
Evidence from mechanistic probes for distinct hydroperoxide rearrangement mechanisms in the intradiol and extradiol catechol dioxygenases. Journal of the American Chemical Society 20080806
Examination and expansion of the substrate range of m-hydroxybenzoate hydroxylase. Biochemical and biophysical research communications 20080620
Modulation of signal transduction pathways in lymphocytes due to sub-lethal toxicity of chlorinated phenol. Toxicology letters 20080610
Diacetonitrile-tetra-kis{μ(2)-3-anilinocarbonyl-1-[(5-chloro-2-oxidophen-yl)diazen-yl]-2-naphtholato}tetra-aqua-diiron(III)disodium(I) dihydrate. Acta crystallographica. Section E, Structure reports online 20080101
Comparative study of multi walled carbon nanotubes-based electrodes in micellar media and their application to micellar electrokinetic capillary chromatography. Talanta 20071215
Online preconcentration using monoliths in electrochromatography capillary format and microchips. Journal of separation science 20071101
Influence of position of substituent groups on removal of chlorophenols and cresols by horseradish peroxidase and determination of optimum conditions. Bioscience, biotechnology, and biochemistry 20071001
Removal of 3-chlorophenol from water using rice-straw-based carbon. Journal of hazardous materials 20070817
Polyphasic characterization of a PCP-to-phenol dechlorinating microbial community enriched from paddy soil. The Science of the total environment 20070801
Analytical applications of glassy carbon electrodes modified with multi-wall carbon nanotubes dispersed in polyethylenimine as detectors in flow systems. Analytica chimica acta 20070723
Direct determination of chlorophenols in environmental water samples by hollow fiber supported ionic liquid membrane extraction coupled with high-performance liquid chromatography. Journal of chromatography. A 20070119
Microbial sulfate reduction and metal attenuation in pH 4 acid mine water. Geochemical transactions 20070101
Infrared study of chlorophenols and products of their photodegradation. Talanta 20061215
Thermodynamics of monochlorophenol isomers and pyrite interfacial interactions in the activation state. Journal of colloid and interface science 20060501
Toxicity measurements in aqueous solution during ozonation of mono-chlorophenols. Journal of environmental management 20060201
Chlorinated phenol analysis using off-line solid-phase extraction and capillary electrophoresis coupled with amperometric detection and a boron-doped diamond microelectrode. Analytical chemistry 20051015
Impact of induced fit on ligand binding to the androgen receptor: a multidimensional QSAR study to predict endocrine-disrupting effects of environmental chemicals. Journal of medicinal chemistry 20050908
Decoys for docking. Journal of medicinal chemistry 20050602
Calculating virtual log P in the alkane/water system (log P(N)(alk)) and its derived parameters deltalog P(N)(oct-alk) and log D(pH)(alk). Journal of medicinal chemistry 20050505
Effect of hydrogen peroxide on the decomposition of monochlorophenols by sonolysis in aqueous solution. Water research 20050301
Metal-mediated chlorinated dibenzo-p-dioxin (CDD) and dibenzofuran (CDF) formation from phenols. Chemosphere 20050201
Structures of the monofluoro- and monochlorophenols at low temperature and high pressure. Acta crystallographica. Section B, Structural science 20050201
Molecular analysis of Desulfitobacterium frappieri pcp-1 involved in reductive dehalogenation of pentachlorophenol. Water science and technology : a journal of the International Association on Water Pollution Research 20050101
Removal of chlorophenols from groundwater by chitosan sorption. Water research 20040501
Sensitivity enhancement of chlorinated phenols by continuous flow liquid membrane extraction followed by capillary electrophoresis. Journal of separation science 20040501
Solid-phase microextraction of phenol compounds using a fused-silica fiber coated with beta-cyclodextrin-bonded silica particles. Analytical sciences : the international journal of the Japan Society for Analytical Chemistry 20040401
Aerobic biodegradation of 3-chlorophenol in a sequencing batch reactor: effect of cometabolism. Water science and technology : a journal of the International Association on Water Pollution Research 20040101
A kinetic study of 3-chlorophenol enhanced hydroxyl radical generation during ozonation. Water research 20031201
Biosensors for phenol derivatives using biochemical signal amplification. Talanta 20031112
Study of 202 natural, synthetic, and environmental chemicals for binding to the androgen receptor. Chemical research in toxicology 20031001
Oxidative transformation of triclosan and chlorophene by manganese oxides. Environmental science & technology 20030601
Hydrogen peroxide lifetime as an indicator of the efficiency of 3-chlorophenol Fenton's and Fenton-like oxidation in soils. Journal of hazardous materials 20030131
Reaction mechanism of 3-chlorophenol with OH, H in aqueous solution. Journal of environmental sciences (China) 20030101
Biodegradation of 3-chlorophenol in a sequencing batch reactor. Journal of environmental science and health. Part A, Toxic/hazardous substances & environmental engineering 20030101
A model binding site for testing scoring functions in molecular docking. Journal of molecular biology 20020913
Substrate-dependent autoaggregation of Pseudomonas putida CP1 during the degradation of mono-chlorophenols and phenol. Journal of industrial microbiology & biotechnology 20020601
Developing and sustaining 3-chlorophenol-degrading populations in up-flow anaerobic column reactors under circum-denitrifying conditions. Applied microbiology and biotechnology 20020601
Rational determination of transfer free energies of small drugs across the water-oil interface. Journal of medicinal chemistry 20020103
Variation of toxicity during the ozonation of monochlorophenolic solutions. Journal of environmental science and health. Part A, Toxic/hazardous substances & environmental engineering 20020101
Adsorption of phenols by papermill sludges. Environmental pollution (Barking, Essex : 1987) 20020101
Adsorption of phenol and m-chlorophenol on organobentonites and repeated thermal regeneration. Waste management (New York, N.Y.) 20020101
Organic pollutants in surface waters from Portugal using chemometric interpretation. Environmental technology 20010901
Detection of phenolic compounds in flow systems based on tyrosinase-modified reticulated vitreous carbon electrodes. Talanta 20010803
ElogD(oct): a tool for lipophilicity determination in drug discovery. 2. Basic and neutral compounds. Journal of medicinal chemistry 20010719
Enhanced selection of an anaerobic pentachlorophenol-degrading consortium. Biotechnology and bioengineering 20010620
Fast determination of phenols in contaminated soils. Journal of chromatography. A 20010309
3-Chlorophenol elimination upon excitation of dilute iron(III) solution: evidence for the only involvement of Fe(OH)2+. Chemosphere 20010201
Adsorption of dyes and phenols from water on the activated carbons prepared from corncob wastes. Environmental technology 20010201
Temperature dependence of DCDD/F isomer distributions from chlorophenol precursors. Chemosphere 20010101
Properties