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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H7ClFNO2
Molecular Weight 203.598
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Methyl 2-amino-4-chloro-5-fluorobenzoate

SMILES

COC(=O)C1=CC(F)=C(Cl)C=C1N

InChI

InChIKey=GLUDXCLLUWRJRA-UHFFFAOYSA-N
InChI=1S/C8H7ClFNO2/c1-13-8(12)4-2-6(10)5(9)3-7(4)11/h2-3H,11H2,1H3

HIDE SMILES / InChI

Approval Year

Unknown
149124
Name Type Language
Methyl 2-amino-4-chloro-5-fluorobenzoate
Systematic Name English
2-Amino-4-chloro-5-fluoro-benzoic acid methyl ester
Preferred Name English
Methyl 4-chloro-5-fluoroanthranilate
Systematic Name English
Benzoic acid, 2-amino-4-chloro-5-fluoro-, methyl ester
Systematic Name English
Code System Code Type Description
CAS
104901-79-3
Created by admin on Wed Apr 02 19:16:19 GMT 2025 , Edited by admin on Wed Apr 02 19:16:19 GMT 2025
PRIMARY
PUBCHEM
13694375
Created by admin on Wed Apr 02 19:16:19 GMT 2025 , Edited by admin on Wed Apr 02 19:16:19 GMT 2025
PRIMARY
FDA UNII
D3G2N62QN6
Created by admin on Wed Apr 02 19:16:19 GMT 2025 , Edited by admin on Wed Apr 02 19:16:19 GMT 2025
PRIMARY
NIH
NCATS
PRIVACY NOTICE
ACCESSIBILITY
DISCLAIMER
HHS VULNERABILITY DISCLOSURE
For language access assistance, contact the NCATS Public Information Officer
National Center for Advancing Translational Sciences (NCATS),
6701 Democracy Boulevard, Bethesda MD 20892-4874 • 301-594-8966