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

Details

Stereochemistry ACHIRAL
Molecular Formula C12Cl8O2
Molecular Weight 459.751
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OCTACHLORODIBENZO-P-DIOXIN

SMILES

ClC1=C(Cl)C2=C(OC3=C(O2)C(Cl)=C(Cl)C(Cl)=C3Cl)C(Cl)=C1Cl

InChI

InChIKey=FOIBFBMSLDGNHL-UHFFFAOYSA-N
InChI=1S/C12Cl8O2/c13-1-2(14)6(18)10-9(5(1)17)21-11-7(19)3(15)4(16)8(20)12(11)22-10

HIDE SMILES / InChI

Molecular Formula C12Cl8O2
Molecular Weight 459.751
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

Substance Class Chemical
Record UNII
YW59P10266
Record Status Validated (UNII)
Record Version