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24613-03-4

24613-03-4 | Benzenamine, N-chloro-

CAS No: 24613-03-4 Catalog No: AG002ORL MDL No:

Product Description

Catalog Number:
AG002ORL
Chemical Name:
Benzenamine, N-chloro-
CAS Number:
24613-03-4
Molecular Formula:
C6H6ClN
Molecular Weight:
127.5715
IUPAC Name:
N-chloroaniline
InChI:
InChI=1S/C6H6ClN/c7-8-6-4-2-1-3-5-6/h1-5,8H
InChI Key:
KUDPGZONDFORKU-UHFFFAOYSA-N
SMILES:
ClNc1ccccc1
NSC Number:
86669
UN Number:
2019

Properties

Complexity:
59.5  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
127.019g/mol
Formal Charge:
0
Heavy Atom Count:
8  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
127.571g/mol
Monoisotopic Mass:
127.019g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  

Literature

Title Journal
Solvent-free selective hydrogenation of chloronitrobenzene to chloroaniline over a robust Pt/Fe3O4 catalyst. Chemical communications (Cambridge, England) 20120325
Adsorptive removal of methylene blue by agar: effects of NaCl and ethanol. Chemistry Central journal 20120101
(E,E)-4-{4-[3-(4-Chloro-anilino)-1-hydroxy-but-2-enyl-idene]-3-methyl-5-oxo-4,5-dihydro-1H-pyrazol-1-yl}-benzene-sulfonamide. Acta crystallographica. Section E, Structure reports online 20110701
Core@shell bimetallic nanoparticle synthesis via anion coordination. Nature chemistry 20110601
Development of an HPLC method for determination of pentachloronitrobenzene, hexachlorobenzene and their possible metabolites. BMC chemical biology 20110101
Existence of inverted profile in chemically responsive molecular pathways in the zebrafish liver. PloS one 20110101
Ethyl 2-acetyl-3-(4-chloro-anilino)butanoate. Acta crystallographica. Section E, Structure reports online 20090901
Clinical outcomes and kinetics of propanil following acute self-poisoning: a prospective case series. BMC clinical pharmacology 20090101
Adsorption of chlorophenol, chloroaniline and methylene blue on fuel oil fly ash. Journal of hazardous materials 20080915
ECVAM retrospective validation of in vitro micronucleus test (MNT). Mutagenesis 20080701
Exclusive production of chloroaniline from chloronitrobenzene over Au/TiO2 and Au/Al2O3. ChemSusChem 20080101
Selection of representative congener for polychlorinated trans-azobenzenes (PCt-ABs) based on comprehensive thermodynamical and quantum-chemical characterization. Journal of environmental science and health. Part. B, Pesticides, food contaminants, and agricultural wastes 20060101
Experimental and computational investigation of the energetics of the three isomers of monochloroaniline. The journal of physical chemistry. B 20050714
Occupational bladder cancer in a 4,4 -methylenebis(2-chloroaniline) (MBOCA)-exposed worker. Environmental health perspectives 20050601
[The problems of multiple-chemical sensitivity patients in using medicinal drugs]. Yakugaku zasshi : Journal of the Pharmaceutical Society of Japan 20040801
Photochemical reaction of N,N-dimethyl-4-chloroaniline with dienes: new synthetic paths via a phenyl cation. Chemistry (Weinheim an der Bergstrasse, Germany) 20030404
Nonbenzamidine isoxazoline derivatives as factor Xa inhibitors. Bioorganic & medicinal chemistry letters 20030324
Diversity of 3-chloroaniline and 3,4-dichloroaniline degrading bacteria isolated from three different soils and involvement of their plasmids in chloroaniline degradation. FEMS microbiology ecology 20021101
Assessment of chloroaniline toxicity by the submitochondrial particle assay. Environmental toxicology and chemistry 20010401
[Treatment of dilute solution anilines-containing with displacement by extraction]. Huan jing ke xue= Huanjing kexue 20010101

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