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

Details

Stereochemistry ACHIRAL
Molecular Formula C12H5Cl5O
Molecular Weight 342.433
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,3',4,4',5-PENTACHLORODIPHENYL ETHER

SMILES

ClC1=CC=C(OC2=CC(Cl)=C(Cl)C(Cl)=C2)C=C1Cl

InChI

InChIKey=WDBLKMRZRGLISL-UHFFFAOYSA-N
InChI=1S/C12H5Cl5O/c13-8-2-1-6(3-9(8)14)18-7-4-10(15)12(17)11(16)5-7/h1-5H

HIDE SMILES / InChI

Approval Year

Name Type Language
3,3',4,4',5-PENTACHLORODIPHENYL ETHER
Common Name English
PCDE 126
Common Name English
BENZENE, 1,2,3-TRICHLORO-5-(3,4-DICHLOROPHENOXY)-
Systematic Name English
Code System Code Type Description
CAS
94339-59-0
Created by admin on Sat Dec 16 09:27:22 GMT 2023 , Edited by admin on Sat Dec 16 09:27:22 GMT 2023
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FDA UNII
CI6086902P
Created by admin on Sat Dec 16 09:27:22 GMT 2023 , Edited by admin on Sat Dec 16 09:27:22 GMT 2023
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PUBCHEM
92419
Created by admin on Sat Dec 16 09:27:22 GMT 2023 , Edited by admin on Sat Dec 16 09:27:22 GMT 2023
PRIMARY
EPA CompTox
DTXSID60241432
Created by admin on Sat Dec 16 09:27:22 GMT 2023 , Edited by admin on Sat Dec 16 09:27:22 GMT 2023
PRIMARY