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Details

Stereochemistry ACHIRAL
Molecular Formula C18H20ClN5O6
Molecular Weight 437.834
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of 4-((2-CHLORO-4,6-DINITROPHENYL)AZO)-N,N-DIETHYL-2,5-DIMETHOXYANILINE

SMILES

CCN(CC)C1=CC(OC)=C(C=C1OC)\N=N\C2=C(C=C(C=C2Cl)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=KEMVMBHOGQWFSN-QZQOTICOSA-N
InChI=1S/C18H20ClN5O6/c1-5-22(6-2)14-10-16(29-3)13(9-17(14)30-4)20-21-18-12(19)7-11(23(25)26)8-15(18)24(27)28/h7-10H,5-6H2,1-4H3/b21-20+

HIDE SMILES / InChI

Molecular Formula C18H20ClN5O6
Molecular Weight 437.834
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 18:38:09 GMT 2025
Edited
by admin
on Tue Apr 01 18:38:09 GMT 2025
Record UNII
9X8ACQ7J9P
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-((2-CHLORO-4,6-DINITROPHENYL)AZO)-N,N-DIETHYL-2,5-DIMETHOXYANILINE
Systematic Name English
4-(2-(2-CHLORO-4,6-DINITROPHENYL)DIAZENYL)-N,N-DIETHYL-2,5-DIMETHOXYBENZENAMINE
Preferred Name English
BENZENAMINE, 4-((2-CHLORO-4,6-DINITROPHENYL)AZO)-N,N-DIETHYL-2,5-DIMETHOXY-
Systematic Name English
Code System Code Type Description
PUBCHEM
174245
Created by admin on Tue Apr 01 18:38:09 GMT 2025 , Edited by admin on Tue Apr 01 18:38:09 GMT 2025
PRIMARY
CAS
81711-69-5
Created by admin on Tue Apr 01 18:38:09 GMT 2025 , Edited by admin on Tue Apr 01 18:38:09 GMT 2025
PRIMARY
ECHA (EC/EINECS)
279-800-9
Created by admin on Tue Apr 01 18:38:09 GMT 2025 , Edited by admin on Tue Apr 01 18:38:09 GMT 2025
PRIMARY
EPA CompTox
DTXSID8072873
Created by admin on Tue Apr 01 18:38:09 GMT 2025 , Edited by admin on Tue Apr 01 18:38:09 GMT 2025
PRIMARY
FDA UNII
9X8ACQ7J9P
Created by admin on Tue Apr 01 18:38:09 GMT 2025 , Edited by admin on Tue Apr 01 18:38:09 GMT 2025
PRIMARY