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Details

Stereochemistry ACHIRAL
Molecular Formula C14H7F5O2
Molecular Weight 302.1962
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of Benzyl pentafluorobenzoate

SMILES

FC1=C(F)C(F)=C(C(=O)OCC2=CC=CC=C2)C(F)=C1F

InChI

InChIKey=WLPUFAZAMBXLPF-UHFFFAOYSA-N
InChI=1S/C14H7F5O2/c15-9-8(10(16)12(18)13(19)11(9)17)14(20)21-6-7-4-2-1-3-5-7/h1-5H,6H2

HIDE SMILES / InChI

Molecular Formula C14H7F5O2
Molecular Weight 302.1962
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 Wed Apr 02 20:54:12 GMT 2025
Edited
by admin
on Wed Apr 02 20:54:12 GMT 2025
Record UNII
PVN864MED2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,3,4,5,6-Pentafluorobenzoic acid benzyl ester
Preferred Name English
Benzyl pentafluorobenzoate
Systematic Name English
Benzoic acid, pentafluoro-, phenylmethyl ester
Systematic Name English
Phenylmethyl 2,3,4,5,6-pentafluorobenzoate
Systematic Name English
Code System Code Type Description
FDA UNII
PVN864MED2
Created by admin on Wed Apr 02 20:54:12 GMT 2025 , Edited by admin on Wed Apr 02 20:54:12 GMT 2025
PRIMARY
CAS
104856-46-4
Created by admin on Wed Apr 02 20:54:12 GMT 2025 , Edited by admin on Wed Apr 02 20:54:12 GMT 2025
PRIMARY
PUBCHEM
517856
Created by admin on Wed Apr 02 20:54:12 GMT 2025 , Edited by admin on Wed Apr 02 20:54:12 GMT 2025
PRIMARY