Home Nitros 2-Chloro-4-nitroaniline

2-Chloro-4-nitroaniline

CAS No.:
121-87-9
Catalog Number:
AG003867
Molecular Formula:
C6H5ClN2O2
Molecular Weight:
172.5691
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$25
- +
100g
98%
In Stock USA
United States
$63
- +
Product Description
Catalog Number:
AG003867
Chemical Name:
2-Chloro-4-nitroaniline
CAS Number:
121-87-9
Molecular Formula:
C6H5ClN2O2
Molecular Weight:
172.5691
MDL Number:
MFCD00007665
IUPAC Name:
2-chloro-4-nitroaniline
InChI:
InChI=1S/C6H5ClN2O2/c7-5-3-4(9(10)11)1-2-6(5)8/h1-3H,8H2
InChI Key:
LOCWBQIWHWIRGN-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1)Cl)N
EC Number:
204-502-2
UNII:
XSA3ZX337B
NSC Number:
3548
RTECS Number:
BX1400000
UN Number:
2237
Properties
Complexity:
159  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.004g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
172.568g/mol
Monoisotopic Mass:
172.004g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
71.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Literature
Title Journal
Evaluation of aggregating brain cell cultures for the detection of acute organ-specific toxicity. Toxicology in vitro : an international journal published in association with BIBRA 20130601
Effect of ionic liquid on the determination of aromatic amines as contaminants in hair dyes by liquid chromatography coupled to electrochemical detection. Molecules (Basel, Switzerland) 20120702
1-(Biphenyl-4-ylcarbon-yl)-3-(2-chloro-4-nitro-phen-yl)thio-urea. Acta crystallographica. Section E, Structure reports online 20120501
N-(2-Chloro-4-nitro-phen-yl)maleamic acid monohydrate. Acta crystallographica. Section E, Structure reports online 20120101
(E)-1-[(2-Chloro-4-nitro-phenyl-imino)-meth-yl]naphthalen-2-ol. Acta crystallographica. Section E, Structure reports online 20110701
5-[(2-Chloro-4-nitro-anilino)methyl-idene]-2,2-dimethyl-1,3-dioxane-4,6-dione. Acta crystallographica. Section E, Structure reports online 20110201
2-Bromo-4-nitro-aniline. Acta crystallographica. Section E, Structure reports online 20090301
ECVAM retrospective validation of in vitro micronucleus test (MNT). Mutagenesis 20080701
N-(2-Chloro-4-nitro-phen-yl)-2-nitro-benzamide. Acta crystallographica. Section E, Structure reports online 20080401
Discovery of potent anilide inhibitors against the severe acute respiratory syndrome 3CL protease. Journal of medicinal chemistry 20050630
Aqueous photolysis of niclosamide. Journal of agricultural and food chemistry 20040225
The influence of suspended particles on the acute toxicity of 2-chloro-4-nitro-aniline, cadmium, and pentachlorophenol on the valve movement response of the zebra mussel (Dreissena polymorpha). Archives of environmental contamination and toxicology 20010501
[Toxicity of 4-chloro-2-nitroaniline and 2-chloro-4-nitroaniline to isolated rat hepatocytes]. La Medicina del lavoro 19910101
Properties