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Details

Stereochemistry ACHIRAL
Molecular Formula C11H8N6O2
Molecular Weight 256.2202
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(P-NITROPHENYL)ADENINE

SMILES

NC1=C2N=CNC2=NC(=N1)C3=CC=C(C=C3)[N+]([O-])=O

InChI

InChIKey=LNLVLKGOVNENAN-UHFFFAOYSA-N
InChI=1S/C11H8N6O2/c12-9-8-11(14-5-13-8)16-10(15-9)6-1-3-7(4-2-6)17(18)19/h1-5H,(H3,12,13,14,15,16)

HIDE SMILES / InChI

Molecular Formula C11H8N6O2
Molecular Weight 256.2202
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 Mon Mar 31 22:09:19 GMT 2025
Edited
by admin
on Mon Mar 31 22:09:19 GMT 2025
Record UNII
S99060RJE4
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1H-PURIN-6-AMINE, 2-(4-NITROPHENYL)-
Preferred Name English
2-(P-NITROPHENYL)ADENINE
Common Name English
9H-PURIN-6-AMINE, 2-(4-NITROPHENYL)-
Systematic Name English
Code System Code Type Description
CAS
109875-50-5
Created by admin on Mon Mar 31 22:09:19 GMT 2025 , Edited by admin on Mon Mar 31 22:09:19 GMT 2025
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FDA UNII
S99060RJE4
Created by admin on Mon Mar 31 22:09:19 GMT 2025 , Edited by admin on Mon Mar 31 22:09:19 GMT 2025
PRIMARY
PUBCHEM
5486769
Created by admin on Mon Mar 31 22:09:19 GMT 2025 , Edited by admin on Mon Mar 31 22:09:19 GMT 2025
PRIMARY
EPA CompTox
DTXSID20149066
Created by admin on Mon Mar 31 22:09:19 GMT 2025 , Edited by admin on Mon Mar 31 22:09:19 GMT 2025
PRIMARY