U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C8H4BrNO2
Molecular Weight 226.027
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-Bromoisatin

SMILES

BrC1=CC=C2NC(=O)C(=O)C2=C1

InChI

InChIKey=MBVCESWADCIXJN-UHFFFAOYSA-N
InChI=1S/C8H4BrNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3H,(H,10,11,12)

HIDE SMILES / InChI

Approval Year

Name Type Language
NSC-4980
Preferred Name English
5-Bromoisatin
Systematic Name English
5-Bromo-1H-indole-2,3-dione
Systematic Name English
1H-Indole-2,3-dione, 5-bromo-
Systematic Name English
Isatin, 5-bromo-
Systematic Name English
5-Bromoindole-2,3-dione
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID30236037
Created by admin on Wed Apr 02 19:11:49 GMT 2025 , Edited by admin on Wed Apr 02 19:11:49 GMT 2025
PRIMARY
PUBCHEM
6889
Created by admin on Wed Apr 02 19:11:49 GMT 2025 , Edited by admin on Wed Apr 02 19:11:49 GMT 2025
PRIMARY
NSC
4980
Created by admin on Wed Apr 02 19:11:49 GMT 2025 , Edited by admin on Wed Apr 02 19:11:49 GMT 2025
PRIMARY
ECHA (EC/EINECS)
201-747-7
Created by admin on Wed Apr 02 19:11:49 GMT 2025 , Edited by admin on Wed Apr 02 19:11:49 GMT 2025
PRIMARY
FDA UNII
DZU75P8VY8
Created by admin on Wed Apr 02 19:11:49 GMT 2025 , Edited by admin on Wed Apr 02 19:11:49 GMT 2025
PRIMARY
CAS
87-48-9
Created by admin on Wed Apr 02 19:11:49 GMT 2025 , Edited by admin on Wed Apr 02 19:11:49 GMT 2025
PRIMARY