Home Halogens Dichloroacetonitrile

Dichloroacetonitrile

CAS No.:
3018-12-0
Catalog Number:
AG003PDF
Molecular Formula:
C2HCl2N
Molecular Weight:
109.9420
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
25g
In Stock USA
United States
$255
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500g
In Stock USA
United States
$1396
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Product Description
Catalog Number:
AG003PDF
Chemical Name:
Dichloroacetonitrile
CAS Number:
3018-12-0
Molecular Formula:
C2HCl2N
Molecular Weight:
109.9420
MDL Number:
MFCD00040886
IUPAC Name:
2,2-dichloroacetonitrile
InChI:
InChI=1S/C2HCl2N/c3-2(4)1-5/h2H
InChI Key:
STZZWJCGRKXEFF-UHFFFAOYSA-N
SMILES:
ClC(C#N)Cl
EC Number:
221-159-4
UNII:
O0L64V63M9
NSC Number:
60511
UN Number:
2810
Properties
Complexity:
59.3  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
108.949g/mol
Formal Charge:
0
Heavy Atom Count:
5  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
109.937g/mol
Monoisotopic Mass:
108.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
23.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Population-based in vitro hazard and concentration-response assessment of chemicals: the 1000 genomes high-throughput screening study. Environmental health perspectives 20150501
Dichloroacetonitrile and dichloroacetamide can form independently during chlorination and chloramination of drinking waters, model organic matters, and wastewater effluents. Environmental science & technology 20121002
Effects of temperature, surfactants and skin location on the dermal penetration of haloacetonitriles and chloral hydrate. Journal of exposure science & environmental epidemiology 20120701
Precursors and nitrogen origins of trichloronitromethane and dichloroacetonitrile during chlorination/chloramination. Chemosphere 20120601
Effects of UV 254 irradiation on residual chlorine and DBPs in chlorination of model organic-N precursors in swimming pools. Water research 20120515
Degradation kinetics and N-Nitrosodimethylamine formation during monochloramination of chlortoluron. The Science of the total environment 20120215
Formation of halogenated C-, N-DBPs from chlor(am)ination and UV irradiation of tyrosine in drinking water. Environmental pollution (Barking, Essex : 1987) 20120201
Dichloroacetonitrile induces oxidative stress and developmental apoptotic imbalance in mouse fetal brain. Environmental toxicology and pharmacology 20120101
Impacts of drinking water pretreatments on the formation of nitrogenous disinfection by-products. Bioresource technology 20111201
Formation of nitrogenous disinfection by-products from pre-chloramination. Chemosphere 20111101
Adsorption characteristics of haloacetonitriles on functionalized silica-based porous materials in aqueous solution. Journal of hazardous materials 20110915
[Chlorination byproducts formation potentials of typical nitrogenous organic compounds in water]. Huan jing ke xue= Huanjing kexue 20110701
Chlorination of chlortoluron: kinetics, pathways and chloroform formation. Chemosphere 20110501
Chloramination of nitrogenous contaminants (pharmaceuticals and pesticides): NDMA and halogenated DBPs formation. Water research 20110501
Impact of UV disinfection combined with chlorination/chloramination on the formation of halonitromethanes and haloacetonitriles in drinking water. Environmental science & technology 20110415
Comparison of inclined plate sedimentation and dissolved air flotation for the minimisation of subsequent nitrogenous disinfection by-product formation. Chemosphere 20110401
Quantifying the formation of nitrogen-containing disinfection by-products in chlorinated water using absorbance and fluorescence indexes. Water science and technology : a journal of the International Association on Water Pollution Research 20110101
Heated indoor swimming pools, infants, and the pathogenesis of adolescent idiopathic scoliosis: a neurogenic hypothesis. Environmental health : a global access science source 20110101
3-[2-(1H-Benzimidazol-2-ylsulfan-yl)eth-yl]-1,3-oxazolidin-2-one. Acta crystallographica. Section E, Structure reports online 20101201
Production of various disinfection byproducts in indoor swimming pool waters treated with different disinfection methods. International journal of hygiene and environmental health 20101101
Evaluating and elucidating the formation of nitrogen-contained disinfection by-products during pre-ozonation and chlorination. Chemosphere 20100601
Nitrogenous disinfection byproducts formation and nitrogen origin exploration during chloramination of nitrogenous organic compounds. Water research 20100501
Formation of carbonaceous and nitrogenous disinfection by-products from the chlorination of Microcystis aeruginosa. Water research 20100301
Formation of haloacetamides during chlorination of dissolved organic nitrogen aspartic acid. Journal of hazardous materials 20100115
Influence of the method of reagent addition on dichloroacetonitrile formation during chloramination. Environmental science & technology 20100115
Atom-transfer radical addition reactions catalyzed by RuCp* complexes: a mechanistic study. Chemistry (Weinheim an der Bergstrasse, Germany) 20091102
Chlorination disinfection by-products in drinking water and congenital anomalies: review and meta-analyses. Environmental health perspectives 20091001
Disinfection byproduct formation and fractionation behavior of natural organic matter surrogates. Environmental science & technology 20090801
Volatile disinfection by-product analysis from chlorinated indoor swimming pools. Water research 20090701
Childhood asthma and environmental exposures at swimming pools: state of the science and research recommendations. Environmental health perspectives 20090401
Nitrogen enriched dissolved organic matter (DOM) isolates and their affinity to form emerging disinfection by-products. Water science and technology : a journal of the International Association on Water Pollution Research 20090101
Seasonal variation in drinking water concentrations of disinfection by-products in IZMIR and associated human health risks. The Science of the total environment 20081215
Correlations between organic matter properties and DBP formation during chloramination. Water research 20080401
Swimming in chlorine byproducts. Environmental science & technology 20071001
Volatile disinfection byproduct formation resulting from chlorination of organic-nitrogen precursors in swimming pools. Environmental science & technology 20071001
Dissolved organic nitrogen as a precursor for chloroform, dichloroacetonitrile, N-nitrosodimethylamine, and trichloronitromethane. Environmental science & technology 20070801
Reaction pathways of the diketonitrile degradate of isoxaflutole with hypochlorite in water. Journal of agricultural and food chemistry 20070307
Factors affecting formation of haloacetonitriles, haloketones, chloropicrin and cyanogen halides during chloramination. Water research 20070301
Haloacetonitriles vs. regulated haloacetic acids: are nitrogen-containing DBPs more toxic? Environmental science & technology 20070115
The water disinfectant byproduct dibromoacetonitrile induces apoptosis in rat intestinal epithelial cells: possible role of redox imbalance. Toxicology mechanisms and methods 20060101
Correlations between differential absorbance and the formation of individual DBPs. Water research 20020701
Formation of disinfection by-products in chlorinated swimming pool water. Chemosphere 20020101
Possible role of hydroxyl radicals in the oxidation of dichloroacetonitrile by Fenton-like reaction. Journal of inorganic biochemistry 20010301
Properties