2,4-DINITROANILINE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H5N3O4
Molecular Weight	183.1216
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

NC1=CC=C(C=C1[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=LXQOQPGNCGEELI-UHFFFAOYSA-N

InChI=1S/C6H5N3O4/c7-5-2-1-4(8(10)11)3-6(5)9(12)13/h1-3H,7H2

HIDE SMILES / InChI

Molecular Formula	C6H5N3O4
Molecular Weight	183.1216
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

Title	Date	PubMed
Capillary electrophoresis investigation on the structure-enantioselectivity relationship in synthetic cyclopeptides as chiral selectors.	2001 Sep	11589288
[Prediction of eluotropic sequence of solutes in countercurrent chromatography].	2002 Nov	12682999
Anionic organic guests incorporated in zeolites: adsorption and reactivity of a Meisenheimer complex in faujasites.	2005 Nov 4	16094688
Synthesis, aerobic cytotoxicity, and radiosensitizing activity of novel 2,4-dinitrophenylamine tethered 5-fluorouracil and hydroxyurea.	2006 Dec 1	16990003
Cellular and molecular actions of dinitroaniline and phosphorothioamidate herbicides on Plasmodium falciparum: tubulin as a specific antimalarial target.	2006 Feb	16406111
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.	2006 Nov	16497524
Theoretical simulation of vibrational sum-frequency generation spectra from density functional theory: application to p-nitrothiophenol and 2,4-dinitroaniline.	2009 Aug 24	19514032
Liquid-phase microextraction and fibre-optics-based cuvetteless CCD-array micro-spectrophotometry for trace analysis.	2009 Aug 26	19646583
Toxic masking and synergistic modulation of the estrogenic activity of chemical mixtures in a yeast estrogen screen (YES).	2009 Jul	19499261
Flat-twisted tubing: novel column design for spiral high-speed counter-current chromatography.	2009 Jul 3	19486987
Sensitive determination of strongly polar aromatic amines in water samples by stir bar sorptive extraction based on poly(vinylimidazole-divinylbenzene) monolithic material and liquid chromatographic analysis.	2009 May 15	19339018
[Screening of new 2,4- and 2,6-dinitroaniline derivates for phytotoxicity and antimitotic activity].	2009 Sep-Oct	20458960
Studies on the effect of column angle in centrifugal helix counter-current chromatography.	2010 Apr 2	20188375
Simultaneous determination of five nitroaniline and dinitroaniline isomers in wastewaters by solid-phase extraction and high-performance liquid chromatography with ultraviolet detection.	2010 Sep	20663537

Patents

Substance Class	Chemical Created by `admin` on `Sat Dec 16 01:47:05 GMT 2023` Edited by `admin` on `Sat Dec 16 01:47:05 GMT 2023`
Record UNII	5BI780R6W6
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

2,4-DINITROANILINE

Systematic Name

English

BENZENAMINE, 2,4-DINITRO-

Systematic Name

English

2,4-DINITROANILINE [MI]

Common Name

English

2,4-DINITROBENZAMINE

Common Name

English

NSC-8731

Code

English

Code System Code Type Description

WIKIPEDIA

2,4-Dinitroaniline