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Details

Stereochemistry ACHIRAL
Molecular Formula C7H6N2O4
Molecular Weight 182.1335
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,4-DINITROTOLUENE

SMILES

CC1=CC=C(C(=C1)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=INYDMNPNDHRJQJ-UHFFFAOYSA-N
InChI=1S/C7H6N2O4/c1-5-2-3-6(8(10)11)7(4-5)9(12)13/h2-4H,1H3

HIDE SMILES / InChI

Molecular Formula C7H6N2O4
Molecular Weight 182.1335
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
The response of adult rat sertoli cells, immortalized by a temperature-sensitive mutant of SV40, to 1,2-dinitrobenzene, 1,3-dinitrobenzene, 2,4-dinitrotoluene, 3,4-dinitrotoluene, and cadmium.
2003 Apr
Gas chromatography positive chemical ionization and tandem mass spectrometry for the analysis of organic high explosives.
2005 Aug 15
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:15:16 GMT 2023
Edited
by admin
on Fri Dec 15 19:15:16 GMT 2023
Record UNII
V6PS4L6ZHT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,4-DINITROTOLUENE
HSDB  
Systematic Name English
NSC-52216
Code English
1-METHYL-3,4-DINITROBENZENE
Systematic Name English
5-METHYL-1,2-DINITROBENZENE
Systematic Name English
DINITROTOLUENE, 3,4-
Systematic Name English
3,4-DINITROTOLUENE [HSDB]
Common Name English
4-METHYL-1,2-DINITROBENZENE
Systematic Name English
BENZENE, 4-METHYL-1,2-DINITRO-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID8027240
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY
CHEBI
142285
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY
PUBCHEM
11883
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY
CAS
610-39-9
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY
HSDB
5501
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY
ECHA (EC/EINECS)
210-222-1
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY
FDA UNII
V6PS4L6ZHT
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY
NSC
52216
Created by admin on Fri Dec 15 19:15:16 GMT 2023 , Edited by admin on Fri Dec 15 19:15:16 GMT 2023
PRIMARY