U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C6H7N3O2.2ClH
Molecular Weight 226.061
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-NITRO-O-PHENYLENEDIAMINE DIHYDROCHLORIDE

SMILES

Cl.Cl.NC1=CC=C(C=C1N)[N+]([O-])=O

InChI

InChIKey=JMSFOGFLPAGXLG-UHFFFAOYSA-N
InChI=1S/C6H7N3O2.2ClH/c7-5-2-1-4(9(10)11)3-6(5)8;;/h1-3H,7-8H2;2*1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C6H7N3O2
Molecular Weight 153.1387
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Modulatory effect of phenolic fractions of Terminalia arjuna on the mutagenicity in Ames assay.
2002
Separation and determination of nitrobenzenes by micellar electrokinetic chromatography and high-performance liquid chromatography.
2002 Dec 6
Antimutagenic activities of acetone and methanol fractions of Terminalia arjuna.
2002 Oct
Antiperoxidative, anti-inflammatory, and antimutagenic activities of ethanol extract of the mycelium of Ganoderma lucidum occurring in South India.
2003
Antimutagenic activity of spearmint.
2004
Enhancement of the morphological transformation of Syrian hamster embryo (SHE) cells by reducing incubation time of the target cells.
2004 Apr 14
Antimutagenicity of herbal detoxification formula Smoke Shield against environmental mutagens.
2004 Mar
Antimutagenicity of coriander (Coriandrum sativum) juice on the mutagenesis produced by plant metabolites of aromatic amines.
2004 Nov 2
Evaluation of the cytotoxicity, genotoxicity, mutagenicity, and antimutagenicity of propolis from Tucuman, Argentina.
2005 Nov 16
Antimutagenic and anti-oxidant activities of the non-steroidal anti-inflammatory drug celecoxib.
2005 Oct
Surface plasmon resonance spectroscopy and electrochemistry study of 4-nitro-1,2-phenylenediamine: a switchable redox polymer with nitro functional groups.
2006 Apr 11
Differences in gene expression profiles in the liver between carcinogenic and non-carcinogenic isomers of compounds given to rats in a 28-day repeat-dose toxicity study.
2006 Dec 15
A comparative study on the antimutagenicity of atorvastatin and lovastatin against directly acting mutagens.
2006 Jul
Antimutagenic activity of methanolic extract of Ganoderma lucidum and its effect on hepatic damage caused by benzo[a]pyrene.
2006 Sep 19
Oxidative DNA damage induced by hair dye components ortho-phenylenediamines and the enhancement by superoxide dismutase.
2006 Sep 5
Accurate reproduction of 161 small-molecule complex crystal structures using the EUDOC program: expanding the use of EUDOC to supramolecular chemistry.
2007 Jun 13
2-amino-4-nitroaniline, a known compound with unexpected properties.
2007 Oct 11
Evaluation of comparative and combined antimutagenic potential of vitamin C and vitamin E using histidine mutant Salmonella typhimurium strains.
2008 Jan
Single strand dna breaks in human lymphocytes exposed to para-phenylenediamine and its derivatives.
2008 Jan
Determination of genotoxic, antigenotoxic and cytotoxic potential of the extract from lichen Cetraria aculeata (Schreb.) Fr. in vitro.
2008 Jan
Antioxidant and antimutagenic activities of Mexican oregano (Lippia graveolens Kunth).
2008 Mar
1-Methyl-6-nitro-1H-benzimidazole.
2008 Mar 5
Phytochemical, antibacterial, antiproliferative, and antioxidant potentials and DNA damage-protecting activity of Acacia salicina extracts.
2009 Jun
Microwave assisted, one-pot synthesis of 5-nitro- 2-aryl substituted-1H-benzimidazole libraries: screening in vitro for antimicrobial activity.
2009 Oct
Validation of an in vitro screening test for predicting the tumor promoting potential of chemicals based on gene expression.
2010 Apr
Determination of Se(IV) in natural waters by adsorptive stripping voltammetry of 5-nitropiazselenol.
2010 Feb 15
Modulatory role of alizarin from Rubia cordifolia L. against genotoxicity of mutagens.
2010 Jan
Antimutagenic and antioxidant potentials of Teucrium ramosissimum essential oil.
2010 Jul
Antimutagenic activities of two suspected anticarcinogenic bifunctional organoiron seleno-terephthalate derivatives.
2010 Jul
Phlomis mauritanica extracts reduce the xanthine oxidase activity, scavenge the superoxide anions, and inhibit the aflatoxin B1-, sodium azide-, and 4-nitrophenyldiamine-induced mutagenicity in bacteria.
2010 Jun
Antioxidant, antimutagenic, and antidiabetic activities of edible leaves from Cnidoscolus chayamansa Mc. Vaugh.
2010 Mar
4-Chloro-2-(6-nitro-1H-benzimidazol-2-yl)phenol N,N-dimethyl-form-amide solvate.
2010 Oct 20
Oxidative Stress Mechanisms Do Not Discriminate between Genotoxic and Nongenotoxic Liver Carcinogens.
2015 Aug 17
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 01:11:52 GMT 2023
Edited
by admin
on Sat Dec 16 01:11:52 GMT 2023
Record UNII
10T46XHE84
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-NITRO-O-PHENYLENEDIAMINE DIHYDROCHLORIDE
INCI  
INCI  
Official Name English
4-NITRO-O-PHENYLENEDIAMINE DIHYDROCHLORIDE [INCI]
Common Name English
1,2-BENZENEDIAMINE, 4-NITRO-, HYDROCHLORIDE (1:2)
Systematic Name English
C.I. 76021
Common Name English
4-NITRO-1,2-BENZENEDIAMINE DIHYDROCHLORIDE [HSDB]
Common Name English
O-PHENYLENEDIAMINE, 4-NITRO-, DIHYDROCHLORIDE
Common Name English
1,2-BENZENEDIAMINE, 4-NITRO-, DIHYDROCHLORIDE
Common Name English
Code System Code Type Description
ECHA (EC/EINECS)
228-293-2
Created by admin on Sat Dec 16 01:11:52 GMT 2023 , Edited by admin on Sat Dec 16 01:11:52 GMT 2023
PRIMARY
CAS
6219-77-8
Created by admin on Sat Dec 16 01:11:52 GMT 2023 , Edited by admin on Sat Dec 16 01:11:52 GMT 2023
PRIMARY
PUBCHEM
5360140
Created by admin on Sat Dec 16 01:11:52 GMT 2023 , Edited by admin on Sat Dec 16 01:11:52 GMT 2023
PRIMARY
FDA UNII
10T46XHE84
Created by admin on Sat Dec 16 01:11:52 GMT 2023 , Edited by admin on Sat Dec 16 01:11:52 GMT 2023
PRIMARY
HSDB
6234
Created by admin on Sat Dec 16 01:11:52 GMT 2023 , Edited by admin on Sat Dec 16 01:11:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID8064141
Created by admin on Sat Dec 16 01:11:52 GMT 2023 , Edited by admin on Sat Dec 16 01:11:52 GMT 2023
PRIMARY
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