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Details

Stereochemistry ACHIRAL
Molecular Formula C6H4N4O7
Molecular Weight 244.1186
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,3,5-TRINITRO-2-ACETYLPYRROLE

SMILES

CC(=O)C1=C(C=C(N1[N+]([O-])=O)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=BXUXAZWQNLUDSN-UHFFFAOYSA-N
InChI=1S/C6H4N4O7/c1-3(11)6-4(8(12)13)2-5(9(14)15)7(6)10(16)17/h2H,1H3

HIDE SMILES / InChI

Molecular Formula C6H4N4O7
Molecular Weight 244.1186
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 22:01:26 GMT 2025
Edited
by admin
on Mon Mar 31 22:01:26 GMT 2025
Record UNII
AHP4WND42M
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1-(1,3,5-TRINITRO-1H-PYRROL-2-YL)ETHANONE
Preferred Name English
1,3,5-TRINITRO-2-ACETYLPYRROLE
Systematic Name English
ETHANONE, 1-(1,3,5-TRINITRO-1H-PYRROL-2-YL)-
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID10166409
Created by admin on Mon Mar 31 22:01:26 GMT 2025 , Edited by admin on Mon Mar 31 22:01:26 GMT 2025
PRIMARY
FDA UNII
AHP4WND42M
Created by admin on Mon Mar 31 22:01:26 GMT 2025 , Edited by admin on Mon Mar 31 22:01:26 GMT 2025
PRIMARY
CAS
158366-46-2
Created by admin on Mon Mar 31 22:01:26 GMT 2025 , Edited by admin on Mon Mar 31 22:01:26 GMT 2025
PRIMARY
PUBCHEM
154699
Created by admin on Mon Mar 31 22:01:26 GMT 2025 , Edited by admin on Mon Mar 31 22:01:26 GMT 2025
PRIMARY