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1,2,3,6,7,8-Hexachlorodibenzofuran

PropertiesImage
MNX_IDMNXM32052 Image of MNXM32052
referencechebi:81511
formulaC12H2Cl6O
global charge0
mol weight374.865
InChIKeyJEYJJJXOFWNEHN-UHFFFAOYSA-N
InChIInChI=1S/C12H2Cl6O/c13-4-1-3-7-6(2-5(14)8(15)10(7)17)19-12(3)11(18)9(4)16/h1-2H
SMILESClC1=CC2=C(OC3=C2C(Cl)=C(Cl)C(Cl)=C3)C(Cl)=C1Cl
MNX internals
InChI (mnx)InChI=1/C12H2Cl6O/c13-4-1-3-7-6(2-5(14)8(15)10(7)17)19-12(3)11(18)9(4)16/h1-2H Image of MNXM32052
SMILES (mnx)[CH:1]1=[C:3]2[C:7]3=[C:6]([CH:2]=[C:5]([Cl:14])[C:8]([Cl:15])=[C:10]3[Cl:17])[O:19][C:12]2=[C:11]([Cl:18])[C:9]([Cl:16])=[C:4]1[Cl:13]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd19379
seedM:cpd19379
CHEBI:81511
chebi:81511
kegg.compound:C18109
keggC:C18109
JEYJJJXOFWNEHN-UHFFFAOYSA-N
1,2,3,6,7,8-Hexachlorodibenzofuran
1,2,3,6,7,8-HxCDF
PCDF 121
hmdb:HMDB0244135
JEYJJJXOFWNEHN-UHFFFAOYSA-N
1,2,3,6,7,8-Hexachlorodibenzofuran
1,2,3,6,7,8-HXCDF
3,4,5,10,11,12-hexachloro-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),2,4,6,9,11-hexaene
PCDF 121

keggC:M_C18109
seedM:M_cpd19379
secondary/obsolete/fantasy identifier