2-Methyl-4,6-dinitrophenol

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Systematic / IUPAC Name: 2-Methyl-4,6-dinitrophenol

ID: Reference1552

Other Names: Dinitro-o-cresol;
3,5-Dinitro-2-hydroxytoluene;
Dinitrocresol;
Dinitro;
Dinitrol ; more

Formula: C7H6N2O5

Class: Pesticides/Herbicides

Spectral Data

2-Methyl-4,6-dinitrophenol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

View Mass Spectra

Available MS Data

Used Instruments Orbitrap ID-X with ETD_Cal Gateshead ; Q Exactive Orbitrap
No. of Spectral Trees 3
No. of Spectra 703
Tandem Spectra MS1, MS2, MS3, MS4
Ionization Methods ESI; NSI
Analyzers FT
Last Modification 12/2/2014 1:44:11 PM
View Mass Spec Data > >

Identificators

InChI InChI=1S/C7H6N2O5/c1-4-2-5(8(11)12)3-6(7(4)10)9(13)14/h2-3,10H,1H3
InChI Key ZXVONLUNISGICL-UHFFFAOYSA-N
Canonical SMILES CC1=CC(=CC(=C1O)[N+](=O)[O-])[N+](=O)[O-]
CAS 534521
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Other Names Dinitro-o-cresol;
3,5-Dinitro-2-hydroxytoluene;
Dinitrocresol;
Dinitro;
Dinitrol;
Nitrofan;
Dinitrodendtroxal;
Phenol, 2-methyl-4,6-dinitro-;
o-Cresol, 4,6-dinitro-;
Toluene, 3,5-dinitro-2-hydroxy-;
4,6-Dinitro-2-methylphenol;
Dinitromethyl cyclohexyltrienol;
Sinox;
Antinonin;
Arborol;
Capsine;
Degrassan;
Dekrysil;
Dinurania;
Ditrosol;
Effusan;
Elgetol;
Hedolit;
Hedolite;
Kresamone;
Nitrador;
Prokarbol;
Raphatox;
Sandolin;
Selinon;
Trifocide;
Winterwash;
Dillex;
Elipol;
Extrar;
Detal;
Dinoc;
Lipan;
Rafex;
Sandolin A;
Krezotol 50;
Kreozan;
Trifrina;
Flavin-samdoz;
Kresonite-E;
Chemsect dnoc;
Neudorff DN 50

In Other Databases

PubChem 10800
ChEBI CHEBI:39349
KEGG C18653
ChemSpider 10343
ChemIDPlus 000534521; 063989833; 002312767; 065121768
Wikipedia Dinitro-ortho-cresol
ChEMBL CHEMBL419564