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Details

Stereochemistry ACHIRAL
Molecular Formula C8H8ClN3O4
Molecular Weight 245.62
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-(2-CHLOROETHYL)-2,4-DINITROANILINE

SMILES

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

InChI

InChIKey=KIUINNCYJPPOLM-UHFFFAOYSA-N
InChI=1S/C8H8ClN3O4/c9-3-4-10-7-2-1-6(11(13)14)5-8(7)12(15)16/h1-2,5,10H,3-4H2

HIDE SMILES / InChI

Molecular Formula C8H8ClN3O4
Molecular Weight 245.62
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 18:51:25 GMT 2023
Edited
by admin
on Sat Dec 16 18:51:25 GMT 2023
Record UNII
5Z97HY666H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-(2-CHLOROETHYL)-2,4-DINITROANILINE
Systematic Name English
NSC-194253
Code English
BENZENAMINE, N-(2-CHLOROETHYL)-2,4-DINITRO-
Systematic Name English
ANILINE, N-(2-CHLOROETHYL)-2,4-DINITRO-
Systematic Name English
1-(2-CHLOROETHYL)AMINO-2,4-DINITROBENZENE
Common Name English
N-BETA-CHLOROETHYL-2,4-DINITROANILINE
Common Name English
Code System Code Type Description
NSC
194253
Created by admin on Sat Dec 16 18:51:25 GMT 2023 , Edited by admin on Sat Dec 16 18:51:25 GMT 2023
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EPA CompTox
DTXSID10168549
Created by admin on Sat Dec 16 18:51:25 GMT 2023 , Edited by admin on Sat Dec 16 18:51:25 GMT 2023
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CAS
16830-65-2
Created by admin on Sat Dec 16 18:51:25 GMT 2023 , Edited by admin on Sat Dec 16 18:51:25 GMT 2023
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PUBCHEM
28104
Created by admin on Sat Dec 16 18:51:25 GMT 2023 , Edited by admin on Sat Dec 16 18:51:25 GMT 2023
PRIMARY
FDA UNII
5Z97HY666H
Created by admin on Sat Dec 16 18:51:25 GMT 2023 , Edited by admin on Sat Dec 16 18:51:25 GMT 2023
PRIMARY