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Details

Stereochemistry ACHIRAL
Molecular Formula C6H6ClN
Molecular Weight 127.572
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of M-CHLOROANILINE

SMILES

NC1=CC(Cl)=CC=C1

InChI

InChIKey=PNPCRKVUWYDDST-UHFFFAOYSA-N
InChI=1S/C6H6ClN/c7-5-2-1-3-6(8)4-5/h1-4H,8H2

HIDE SMILES / InChI

Molecular Formula C6H6ClN
Molecular Weight 127.572
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Aniline and 3-chloroaniline degrading bacteria: genetics and possible applications.
2001
The utilization of aniline, chlorinated aniline, and aniline blue as the only source of nitrogen by fungi in water.
2001 Apr
1,4-dioxane-fused 4-anilinoquinazoline as inhibitors of epidermal growth factor receptor kinase.
2001 Nov
Diversity of 3-chloroaniline and 3,4-dichloroaniline degrading bacteria isolated from three different soils and involvement of their plasmids in chloroaniline degradation.
2002 Nov 1
Diversity of activated sludge bacteria receiving the 3-chloroaniline-degradative plasmid pC1gfp.
2003 Nov 1
Chlorpropham induces mitochondrial dysfunction in rat hepatocytes.
2004 Aug 5
Biotransformation of chlorpropham (CIPC) in isolated rat hepatocytes and xenoestrogenic activity of CIPC and its metabolites by in vitro assays.
2004 Mar
Plasmid-mediated bioaugmentation of activated sludge bacteria in a sequencing batch moving bed reactor using pNB2.
2005
Rapid determination of aniline metabolites of chlorpropham in potatoes by micellar electrokinetic chromatography using negative-charged mixed micelles and laser-induced fluorescence detection.
2005 Aug
Two-step hollow fiber-based, liquid-phase microextraction combined with high-performance liquid chromatography: a new approach to determination of aromatic amines in water.
2005 Aug 5
Experimental and computational investigation of the energetics of the three isomers of monochloroaniline.
2005 Jul 14
Prediction of genotoxicity of chemical compounds by statistical learning methods.
2005 Jun
[Degradation of aniline by Delftia tsuruhatensis 14S in batch and continuous processes].
2005 Sep-Oct
Sorption and desorption behavior of chloroanilines and chlorophenols on montmorillonite and kaolinite.
2006
Design and evaluation of 16S rRNA sequence based oligonucleotide probes for the detection and quantification of Comamonas testosteroni in mixed microbial communities.
2006 Jun 13
A mononuclear and a mixed-valence chain polymer arising from copper(II) halide chemistry and the use of 2,2'-pyridil.
2007
Bioaugmentation of activated sludge towards 3-chloroaniline removal with a mixed bacterial population carrying a degradative plasmid.
2009 Jun
Development of a novel virtual screening cascade protocol to identify potential trypanothione reductase inhibitors.
2009 Mar 26
Monoarylamines in the general population--a cross-sectional population-based study including 1004 Bavarian subjects.
2009 May
Ethyl 2-[(3-chloro-phen-yl)hydrazono]-3-oxobutanoate.
2009 May 20
2-(3-Chloro-anilino)pyridine.
2009 May 29
Plasmid-mediated bioaugmentation of wastewater microbial communities in a laboratory-scale bioreactor.
2010
2,2,2-Tribromo-N-(3-chloro-phen-yl)acetamide.
2010 Apr 24
Cadmium alters the biotransformation of carcinogenic aromatic amines by arylamine N-acetyltransferase xenobiotic-metabolizing enzymes: molecular, cellular, and in vivo studies.
2010 Dec
4-Chloro-N-(3-chloro-phen-yl)-2-methyl-benzene-sulfonamide.
2010 Jun 18
Investigating the mechanisms of aromatic amine-induced protein free radical formation by quantitative structure-activity relationships: implications for drug-induced agranulocytosis.
2010 May 17
N-(3-Chloro-phen-yl)-2-hy-droxy-benzamide.
2010 Nov 6
A monoclinic polymorph of N-(3-chloro-phen-yl)benzamide.
2010 Oct 13
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:25:52 GMT 2023
Edited
by admin
on Fri Dec 15 18:25:52 GMT 2023
Record UNII
6GKR52SKIY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
M-CHLOROANILINE
MI  
Systematic Name English
CHLOROANILINE, M-
Systematic Name English
NSC-17581
Code English
3-CHLOROANILINE [HSDB]
Common Name English
3-CHLOROBENZENAMINE
Systematic Name English
3-CHLOROANILINE
HSDB  
Systematic Name English
M-CHLOROANILINE [MI]
Common Name English
Code System Code Type Description
FDA UNII
6GKR52SKIY
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
CAS
108-42-9
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
PUBCHEM
7932
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
MERCK INDEX
m3388
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY Merck Index
ECHA (EC/EINECS)
203-581-0
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID0024761
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
MESH
C031392
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
HSDB
2046
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
NSC
17581
Created by admin on Fri Dec 15 18:25:52 GMT 2023 , Edited by admin on Fri Dec 15 18:25:52 GMT 2023
PRIMARY
Related Record Type Details
SALT/SOLVATE -> PARENT