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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H11N.ClH
Molecular Weight 157.641
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,5-Dimethylaniline hydrochloride

SMILES

Cl.CC1=CC=C(C)C(N)=C1

InChI

InChIKey=XMHFVPVDKGNKPL-UHFFFAOYSA-N
InChI=1S/C8H11N.ClH/c1-6-3-4-7(2)8(9)5-6;/h3-5H,9H2,1-2H3;1H

HIDE SMILES / InChI

Molecular Formula C8H11N
Molecular Weight 121.1796
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

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

Approval Year

PubMed

PubMed

TitleDatePubMed
Enzyme production by Mycena galopus mycelium in artificial media and in Picea sitchensis F1 horizon needle litter.
2003 Aug
Oligomeric compounds formed from 2,5-xylidine (2,5-dimethylaniline) are potent enhancers of laccase production in Trametes versicolor ATCC 32745.
2005 Aug
Prediction of genotoxicity of chemical compounds by statistical learning methods.
2005 Jun
Effects of culture conditions on production of extracellular laccase by Rhizoctonia praticola.
2006
Production, purification and partial characterisation of a novel laccase from the white-rot fungus Panus tigrinus CBS 577.79.
2007 Jan
Crystal structure of a blue laccase from Lentinus tigrinus: evidences for intermediates in the molecular oxygen reductive splitting by multicopper oxidases.
2007 Sep 26
A tannic acid-inducible and hypoviral-regulated Laccase3 contributes to the virulence of the chestnut blight fungus Cryphonectria parasitica.
2008 Dec
N-(2,5-Dimethyl-phen-yl)-4-methyl-benzene-sulfonamide.
2009 Dec 4
Docking simulation and competitive experiments validate the interaction between the 2,5-xylidine inhibitor and Rigidoporus lignosus laccase.
2010 Feb
Patents
Substance Class Chemical
Created
by admin
on Sat Dec 16 10:47:49 GMT 2023
Edited
by admin
on Sat Dec 16 10:47:49 GMT 2023
Record UNII
4G9F2LAR84
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,5-Dimethylaniline hydrochloride
Systematic Name English
Benzenamine, 2,5-dimethyl-, hydrochloride (1:1)
Systematic Name English
Benzenamine, 2,5-dimethyl-, hydrochloride
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID7021449
Created by admin on Sat Dec 16 10:47:49 GMT 2023 , Edited by admin on Sat Dec 16 10:47:49 GMT 2023
PRIMARY
CAS
51786-53-9
Created by admin on Sat Dec 16 10:47:49 GMT 2023 , Edited by admin on Sat Dec 16 10:47:49 GMT 2023
PRIMARY
PUBCHEM
94546
Created by admin on Sat Dec 16 10:47:49 GMT 2023 , Edited by admin on Sat Dec 16 10:47:49 GMT 2023
PRIMARY
FDA UNII
4G9F2LAR84
Created by admin on Sat Dec 16 10:47:49 GMT 2023 , Edited by admin on Sat Dec 16 10:47:49 GMT 2023
PRIMARY