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

Details

Stereochemistry ACHIRAL
Molecular Formula C15H23N3O4
Molecular Weight 309.3608
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ISOPROPALIN

SMILES

CCCN(CCC)C1=C(C=C(C=C1[N+]([O-])=O)C(C)C)[N+]([O-])=O

InChI

InChIKey=NEKOXWSIMFDGMA-UHFFFAOYSA-N
InChI=1S/C15H23N3O4/c1-5-7-16(8-6-2)15-13(17(19)20)9-12(11(3)4)10-14(15)18(21)22/h9-11H,5-8H2,1-4H3

HIDE SMILES / InChI

Molecular Formula C15H23N3O4
Molecular Weight 309.3608
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Dinitroaniline activity in Toxoplasma gondii expressing wild-type or mutant alpha-tubulin.
2010-04
Determination of pesticide residues in soil by modified matrix solid-phase dispersion and gas chromatography.
2007-08
Proximity to crops and residential exposure to agricultural herbicides in iowa.
2006-06
Simultaneous residue measurement of pendimethalin, isopropalin, and butralin in tobacco using high-performance liquid chromatography with ultraviolet detection and electrospray ionization/mass spectrometric identification.
2004-11-17
Abiotic reduction of dinitroaniline herbicides.
2003-10
Substance Class Chemical
Created
by admin
on Mon Mar 31 18:53:06 GMT 2025
Edited
by admin
on Mon Mar 31 18:53:06 GMT 2025
Record UNII
52GZD1I41N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PAARLAN
Preferred Name English
ISOPROPALIN
HSDB   ISO   MI  
Common Name English
ISOPROPALIN [MI]
Common Name English
4-(1-METHYLETHYL)-2,6-DINITRO-N,N-DIPROPYLBENZENAMINE
Systematic Name English
BENZENAMINE, 4-(1-METHYLETHYL)-2,6-DINITRO-N,N-DIPROPYL-
Systematic Name English
CUMIDINE, 2,6-DINITRO-N,N-DIPROPYL-
Common Name English
ISOPROPALIN [HSDB]
Common Name English
4-ISOPROPYL-2,6-DINITRO-N,N-DIPROPYLANILINE
Systematic Name English
EL-179
Code English
ISOPROPALIN [ISO]
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 100201
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
Code System Code Type Description
HSDB
6687
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY
EPA CompTox
DTXSID8024157
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY
PUBCHEM
36606
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY
FDA UNII
52GZD1I41N
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY
ECHA (EC/EINECS)
251-690-7
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY
MERCK INDEX
m251
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY Merck Index
CAS
33820-53-0
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY
ALANWOOD
isopropalin
Created by admin on Mon Mar 31 18:53:06 GMT 2025 , Edited by admin on Mon Mar 31 18:53:06 GMT 2025
PRIMARY