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

Details

Stereochemistry ACHIRAL
Molecular Formula C8H7Cl3O5S
Molecular Weight 321.562
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(2,4,5-TRICHLOROPHENOXY)ETHYL HYDROGEN SULFATE

SMILES

OS(=O)(=O)OCCOC1=CC(Cl)=C(Cl)C=C1Cl

InChI

InChIKey=YWNCRLWPJZLWGH-UHFFFAOYSA-N
InChI=1S/C8H7Cl3O5S/c9-5-3-7(11)8(4-6(5)10)15-1-2-16-17(12,13)14/h3-4H,1-2H2,(H,12,13,14)

HIDE SMILES / InChI

Molecular Formula C8H7Cl3O5S
Molecular Weight 321.562
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 Mon Mar 31 19:33:04 GMT 2025
Edited
by admin
on Mon Mar 31 19:33:04 GMT 2025
Record UNII
HI788A7B5J
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(2,4,5-TRICHLOROPHENOXY)ETHYL HYDROGEN SULFATE
Systematic Name English
2,4,5-TES FREE ACID
Preferred Name English
TRICHLOROPHENOXY)ETHYL SULFATE, 2-(2,4,5-
Common Name English
Classification Tree Code System Code
EPA PESTICIDE CODE 481900
Created by admin on Mon Mar 31 19:33:04 GMT 2025 , Edited by admin on Mon Mar 31 19:33:04 GMT 2025
Code System Code Type Description
PUBCHEM
19130
Created by admin on Mon Mar 31 19:33:04 GMT 2025 , Edited by admin on Mon Mar 31 19:33:04 GMT 2025
PRIMARY
EPA CompTox
DTXSID7058462
Created by admin on Mon Mar 31 19:33:04 GMT 2025 , Edited by admin on Mon Mar 31 19:33:04 GMT 2025
PRIMARY
CAS
69633-04-1
Created by admin on Mon Mar 31 19:33:04 GMT 2025 , Edited by admin on Mon Mar 31 19:33:04 GMT 2025
PRIMARY
FDA UNII
HI788A7B5J
Created by admin on Mon Mar 31 19:33:04 GMT 2025 , Edited by admin on Mon Mar 31 19:33:04 GMT 2025
PRIMARY