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Details

Stereochemistry RACEMIC
Molecular Formula C12H6Cl4O
Molecular Weight 307.987
Optical Activity ( + / - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2',5,5'-TETRACHLOROBIPHENYL 3,4-OXIDE

SMILES

ClC1=CC=C(Cl)C(=C1)C2=C(Cl)[C@H]3O[C@H]3C(Cl)=C2

InChI

InChIKey=HUWUGZREAZTGIP-NWDGAFQWSA-N
InChI=1S/C12H6Cl4O/c13-5-1-2-8(14)6(3-5)7-4-9(15)11-12(17-11)10(7)16/h1-4,11-12H/t11-,12+/m0/s1

HIDE SMILES / InChI

Molecular Formula C12H6Cl4O
Molecular Weight 307.987
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 09:00:31 GMT 2023
Edited
by admin
on Sat Dec 16 09:00:31 GMT 2023
Record UNII
LI1CMH2MT0
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2',5,5'-TETRACHLOROBIPHENYL 3,4-OXIDE
Common Name English
7-OXABICYCLO(4.1.0)HEPTA-2,4-DIENE, 2,5-DICHLORO-3-(2,5-DICHLOROPHENYL)-
Systematic Name English
Code System Code Type Description
CAS
68099-35-4
Created by admin on Sat Dec 16 09:00:31 GMT 2023 , Edited by admin on Sat Dec 16 09:00:31 GMT 2023
NON-SPECIFIC STEREOCHEMISTRY
EPA CompTox
DTXSID40987568
Created by admin on Sat Dec 16 09:00:31 GMT 2023 , Edited by admin on Sat Dec 16 09:00:31 GMT 2023
PRIMARY
FDA UNII
LI1CMH2MT0
Created by admin on Sat Dec 16 09:00:31 GMT 2023 , Edited by admin on Sat Dec 16 09:00:31 GMT 2023
PRIMARY
PUBCHEM
121489661
Created by admin on Sat Dec 16 09:00:31 GMT 2023 , Edited by admin on Sat Dec 16 09:00:31 GMT 2023
PRIMARY