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Details

Stereochemistry ACHIRAL
Molecular Formula C13H8N4O2S
Molecular Weight 284.293
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 4-Nitro-4?-isothiocyanatoazobenzene

SMILES

[O-][N+](=O)C1=CC=C(C=C1)\N=N\C2=CC=C(C=C2)N=C=S

InChI

InChIKey=HQLMTPHMWRDLGZ-FOCLMDBBSA-N
InChI=1S/C13H8N4O2S/c18-17(19)13-7-5-12(6-8-13)16-15-11-3-1-10(2-4-11)14-9-20/h1-8H/b16-15+

HIDE SMILES / InChI

Molecular Formula C13H8N4O2S
Molecular Weight 284.293
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:19:35 GMT 2025
Edited
by admin
on Tue Apr 01 20:19:35 GMT 2025
Record UNII
2N84D48Y8W
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NSC-137466
Preferred Name English
4-Nitro-4?-isothiocyanatoazobenzene
Systematic Name English
(4-Isothiocyanatophenyl)-(4-nitrophenyl)diazene
Systematic Name English
Isothiocyanic acid, p-[(p-nitrophenyl)azo]phenyl ester
Common Name English
1-(4-Isothiocyanatophenyl)-2-(4-nitrophenyl)diazene
Systematic Name English
4-Nitroazobenzene-4?-isothiocyanate
Systematic Name English
Diazene, 1-(4-isothiocyanatophenyl)-2-(4-nitrophenyl)-
Systematic Name English
Code System Code Type Description
CAS
2378644-19-8
Created by admin on Tue Apr 01 20:19:35 GMT 2025 , Edited by admin on Tue Apr 01 20:19:35 GMT 2025
PRIMARY
CAS
24722-66-5
Created by admin on Tue Apr 01 20:19:35 GMT 2025 , Edited by admin on Tue Apr 01 20:19:35 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
NSC
137466
Created by admin on Tue Apr 01 20:19:35 GMT 2025 , Edited by admin on Tue Apr 01 20:19:35 GMT 2025
PRIMARY
EPA CompTox
DTXSID901038649
Created by admin on Tue Apr 01 20:19:35 GMT 2025 , Edited by admin on Tue Apr 01 20:19:35 GMT 2025
PRIMARY
FDA UNII
2N84D48Y8W
Created by admin on Tue Apr 01 20:19:35 GMT 2025 , Edited by admin on Tue Apr 01 20:19:35 GMT 2025
PRIMARY