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

Details

Stereochemistry ACHIRAL
Molecular Formula C10H13N3O4
Molecular Weight 239.2279
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N,N-Diethyl-2,4-dinitroaniline

SMILES

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

InChI

InChIKey=RAYYZJTYTUPECK-UHFFFAOYSA-N
InChI=1S/C10H13N3O4/c1-3-11(4-2)9-6-5-8(12(14)15)7-10(9)13(16)17/h5-7H,3-4H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C10H13N3O4
Molecular Weight 239.2279
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:05:40 GMT 2023
Edited
by admin
on Sat Dec 16 13:05:40 GMT 2023
Record UNII
RRN5TNU9NG
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N,N-Diethyl-2,4-dinitroaniline
Systematic Name English
N,N-Diethyl-2,4-dinitrobenzenamine
Systematic Name English
2,4-Dinitro-N,N-diethylaniline
Systematic Name English
Benzenamine, N,N-diethyl-2,4-dinitro-
Systematic Name English
(2,4-Dinitro-phenyl)-diethyl-amine
Systematic Name English
NSC-42401
Code English
Aniline, N,N-diethyl-2,4-dinitro-
Systematic Name English
AI3-08862
Code English
Code System Code Type Description
PUBCHEM
70045
Created by admin on Sat Dec 16 13:05:40 GMT 2023 , Edited by admin on Sat Dec 16 13:05:40 GMT 2023
PRIMARY
CAS
837-64-9
Created by admin on Sat Dec 16 13:05:40 GMT 2023 , Edited by admin on Sat Dec 16 13:05:40 GMT 2023
PRIMARY
FDA UNII
RRN5TNU9NG
Created by admin on Sat Dec 16 13:05:40 GMT 2023 , Edited by admin on Sat Dec 16 13:05:40 GMT 2023
PRIMARY
EPA CompTox
DTXSID70232533
Created by admin on Sat Dec 16 13:05:40 GMT 2023 , Edited by admin on Sat Dec 16 13:05:40 GMT 2023
PRIMARY
NSC
42401
Created by admin on Sat Dec 16 13:05:40 GMT 2023 , Edited by admin on Sat Dec 16 13:05:40 GMT 2023
PRIMARY