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Details

Stereochemistry ACHIRAL
Molecular Formula C7H3BrFO2.Na
Molecular Weight 240.99
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Sodium 4-bromo-2-fluorobenzoate

SMILES

[Na+].[O-]C(=O)C1=CC=C(Br)C=C1F

InChI

InChIKey=HBYYVKFYZMRBAH-UHFFFAOYSA-M
InChI=1S/C7H4BrFO2.Na/c8-4-1-2-5(7(10)11)6(9)3-4;/h1-3H,(H,10,11);/q;+1/p-1

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Benzoic acid, 4-bromo-2-fluoro-, sodium salt (1:1)
Preferred Name English
Sodium 4-bromo-2-fluorobenzoate
Systematic Name English
Code System Code Type Description
FDA UNII
H3T77D24T3
Created by admin on Wed Apr 02 19:23:49 GMT 2025 , Edited by admin on Wed Apr 02 19:23:49 GMT 2025
PRIMARY
EPA CompTox
DTXSID901014821
Created by admin on Wed Apr 02 19:23:49 GMT 2025 , Edited by admin on Wed Apr 02 19:23:49 GMT 2025
PRIMARY
CAS
1938142-15-4
Created by admin on Wed Apr 02 19:23:49 GMT 2025 , Edited by admin on Wed Apr 02 19:23:49 GMT 2025
PRIMARY
PUBCHEM
138319645
Created by admin on Wed Apr 02 19:23:49 GMT 2025 , Edited by admin on Wed Apr 02 19:23:49 GMT 2025
PRIMARY
NIH
NCATS
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