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Details

Stereochemistry ACHIRAL
Molecular Formula C13H7Cl5O2S
Molecular Weight 404.523
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2',3,4,5'-PENTACHLORO-4'-(METHYLSULFONYL)-1,1'-BIPHENYL

SMILES

CS(=O)(=O)C1=C(Cl)C=C(C(Cl)=C1)C2=CC=C(Cl)C(Cl)=C2Cl

InChI

InChIKey=APTRVLUXSHYLHM-UHFFFAOYSA-N
InChI=1S/C13H7Cl5O2S/c1-21(19,20)11-5-9(15)7(4-10(11)16)6-2-3-8(14)13(18)12(6)17/h2-5H,1H3

HIDE SMILES / InChI

Molecular Formula C13H7Cl5O2S
Molecular Weight 404.523
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 Fri Dec 15 18:32:59 GMT 2023
Edited
by admin
on Fri Dec 15 18:32:59 GMT 2023
Record UNII
9J5A9UF6YT
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2',3,4,5'-PENTACHLORO-4'-(METHYLSULFONYL)-1,1'-BIPHENYL
Systematic Name English
METHYLSULFONYL-2,5,2',3',4'-PENTACHLOROBIPHENYL, 4-
Systematic Name English
4-METHYLSULFONYL-2,2',3',4',5-PENTACHLOROBIPHENYL
Common Name English
1,1'-BIPHENYL, 2,2',3,4,5'-PENTACHLORO-4'-(METHYLSULFONYL)-
Systematic Name English
4'-METHYLSULFONYL-2,3,4,2',5'-PENTACHLOROBIPHENYL
Common Name English
Code System Code Type Description
EPA CompTox
DTXSID00216801
Created by admin on Fri Dec 15 18:32:59 GMT 2023 , Edited by admin on Fri Dec 15 18:32:59 GMT 2023
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PUBCHEM
108210
Created by admin on Fri Dec 15 18:32:59 GMT 2023 , Edited by admin on Fri Dec 15 18:32:59 GMT 2023
PRIMARY
FDA UNII
9J5A9UF6YT
Created by admin on Fri Dec 15 18:32:59 GMT 2023 , Edited by admin on Fri Dec 15 18:32:59 GMT 2023
PRIMARY
CAS
66640-59-3
Created by admin on Fri Dec 15 18:32:59 GMT 2023 , Edited by admin on Fri Dec 15 18:32:59 GMT 2023
PRIMARY