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Details

Stereochemistry ACHIRAL
Molecular Formula C8H6F2O2
Molecular Weight 172.1288
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2,4-difluorobenzoate

SMILES

COC(=O)C1=CC=C(F)C=C1F

InChI

InChIKey=YQUHULOBTDYMAG-UHFFFAOYSA-N
InChI=1S/C8H6F2O2/c1-12-8(11)6-3-2-5(9)4-7(6)10/h2-4H,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
2,4-Difluorobenzoic acid methyl ester
Preferred Name English
Methyl 2,4-difluorobenzoate
Systematic Name English
Benzoic acid, 2,4-difluoro-, methyl ester
Systematic Name English
Code System Code Type Description
CAS
106614-28-2
Created by admin on Wed Apr 02 20:28:50 GMT 2025 , Edited by admin on Wed Apr 02 20:28:50 GMT 2025
PRIMARY
FDA UNII
EJ9VNB43AG
Created by admin on Wed Apr 02 20:28:50 GMT 2025 , Edited by admin on Wed Apr 02 20:28:50 GMT 2025
PRIMARY
PUBCHEM
2782897
Created by admin on Wed Apr 02 20:28:50 GMT 2025 , Edited by admin on Wed Apr 02 20:28:50 GMT 2025
PRIMARY
NIH
NCATS
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