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Details

Stereochemistry RACEMIC
Molecular Formula C8H7Cl3O2
Molecular Weight 241.499
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,4,5-Trichlorophenylethanediol

SMILES

OCC(O)C1=C(Cl)C=C(Cl)C(Cl)=C1

InChI

InChIKey=CWGHUMHHVXHYAY-UHFFFAOYSA-N
InChI=1S/C8H7Cl3O2/c9-5-2-7(11)6(10)1-4(5)8(13)3-12/h1-2,8,12-13H,3H2

HIDE SMILES / InChI

Molecular Formula C8H7Cl3O2
Molecular Weight 241.499
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Tue Apr 01 20:47:01 GMT 2025
Edited
by admin
on Tue Apr 01 20:47:01 GMT 2025
Record UNII
9TS6K39H4H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,4,5-Trichlorophenylethanediol
Systematic Name English
1,2-Ethanediol, 1-(2,4,5-trichlorophenyl)-
Preferred Name English
1-(2,4,5-Trichlorophenyl)-1,2-ethanediol
Systematic Name English
Code System Code Type Description
CAS
14299-53-7
Created by admin on Tue Apr 01 20:47:01 GMT 2025 , Edited by admin on Tue Apr 01 20:47:01 GMT 2025
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FDA UNII
9TS6K39H4H
Created by admin on Tue Apr 01 20:47:01 GMT 2025 , Edited by admin on Tue Apr 01 20:47:01 GMT 2025
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EPA CompTox
DTXSID30778927
Created by admin on Tue Apr 01 20:47:01 GMT 2025 , Edited by admin on Tue Apr 01 20:47:01 GMT 2025
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PUBCHEM
71354262
Created by admin on Tue Apr 01 20:47:01 GMT 2025 , Edited by admin on Tue Apr 01 20:47:01 GMT 2025
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