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Details

Stereochemistry ACHIRAL
Molecular Formula C8H7FO2
Molecular Weight 154.1384
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of METHYL 2-FLUOROBENZOATE

SMILES

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

InChI

InChIKey=QAFJIJWLEBLXHH-UHFFFAOYSA-N
InChI=1S/C8H7FO2/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C8H7FO2
Molecular Weight 154.1384
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 19:07:26 GMT 2025
Edited
by admin
on Tue Apr 01 19:07:26 GMT 2025
Record UNII
X3G278U4YT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
METHYL 2-FLUOROBENZOATE
Systematic Name English
NSC-96624
Preferred Name English
BENZOIC ACID, O-FLUORO-, METHYL ESTER
Systematic Name English
O-FLUOROBENZOIC ACID, METHYL ESTER
Common Name English
METHYL O-FLUOROBENZOATE
Systematic Name English
BENZOIC ACID, 2-FLUORO-, METHYL ESTER
Common Name English
Code System Code Type Description
FDA UNII
X3G278U4YT
Created by admin on Tue Apr 01 19:07:26 GMT 2025 , Edited by admin on Tue Apr 01 19:07:26 GMT 2025
PRIMARY
NSC
96624
Created by admin on Tue Apr 01 19:07:26 GMT 2025 , Edited by admin on Tue Apr 01 19:07:26 GMT 2025
PRIMARY
ECHA (EC/EINECS)
206-894-0
Created by admin on Tue Apr 01 19:07:26 GMT 2025 , Edited by admin on Tue Apr 01 19:07:26 GMT 2025
PRIMARY
EPA CompTox
DTXSID1059941
Created by admin on Tue Apr 01 19:07:26 GMT 2025 , Edited by admin on Tue Apr 01 19:07:26 GMT 2025
PRIMARY
PUBCHEM
67854
Created by admin on Tue Apr 01 19:07:26 GMT 2025 , Edited by admin on Tue Apr 01 19:07:26 GMT 2025
PRIMARY
CAS
394-35-4
Created by admin on Tue Apr 01 19:07:26 GMT 2025 , Edited by admin on Tue Apr 01 19:07:26 GMT 2025
PRIMARY