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

Details

Stereochemistry ACHIRAL
Molecular Formula C7H4FNO4
Molecular Weight 185.1094
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-Fluoro-2-nitrobenzoic acid

SMILES

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

InChI

InChIKey=YLUCXHMYRQUERW-UHFFFAOYSA-N
InChI=1S/C7H4FNO4/c8-4-1-2-5(7(10)11)6(3-4)9(12)13/h1-3H,(H,10,11)

HIDE SMILES / InChI

Approval Year

Name Type Language
Benzoic acid, 4-fluoro-2-nitro-
Preferred Name English
4-Fluoro-2-nitrobenzoic acid
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
206-890-9
Created by admin on Tue Apr 01 19:38:11 GMT 2025 , Edited by admin on Tue Apr 01 19:38:11 GMT 2025
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FDA UNII
XLA7LVL3HK
Created by admin on Tue Apr 01 19:38:11 GMT 2025 , Edited by admin on Tue Apr 01 19:38:11 GMT 2025
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PUBCHEM
2737416
Created by admin on Tue Apr 01 19:38:11 GMT 2025 , Edited by admin on Tue Apr 01 19:38:11 GMT 2025
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EPA CompTox
DTXSID50192585
Created by admin on Tue Apr 01 19:38:11 GMT 2025 , Edited by admin on Tue Apr 01 19:38:11 GMT 2025
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CAS
394-01-4
Created by admin on Tue Apr 01 19:38:11 GMT 2025 , Edited by admin on Tue Apr 01 19:38:11 GMT 2025
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