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1,2,3,7,8-Pentachlorodibenzofuran

PropertiesImage
MNX_IDMNXM32056 Image of MNXM32056
referencechebi:81507
formulaC12H3Cl5O
global charge0
mol weight340.42
InChIKeySBMIVUVRFPGOEB-UHFFFAOYSA-N
InChIInChI=1S/C12H3Cl5O/c13-5-1-4-8(2-6(5)14)18-9-3-7(15)11(16)12(17)10(4)9/h1-3H
SMILESClC1=CC2=C(C=C1Cl)C1=C(C=C(Cl)C(Cl)=C1Cl)O2
MNX internals
InChI (mnx)InChI=1/C12H3Cl5O/c13-5-1-4-8(2-6(5)14)18-9-3-7(15)11(16)12(17)10(4)9/h1-3H Image of MNXM32056
SMILES (mnx)[CH:1]1=[C:4]2[C:8](=[CH:2][C:6]([Cl:14])=[C:5]1[Cl:13])[O:18][C:9]1=[C:10]2[C:12]([Cl:17])=[C:11]([Cl:16])[C:7]([Cl:15])=[CH:3]1
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:cpd19375
seedM:cpd19375
CHEBI:81507
chebi:81507
kegg.compound:C18105
keggC:C18105
SBMIVUVRFPGOEB-UHFFFAOYSA-N
1,2,3,7,8-Pentachlorodibenzofuran
1,2,3,7,8-PeCDF
PCDF 94
hmdb:HMDB0244137
SBMIVUVRFPGOEB-UHFFFAOYSA-N
1,2,3,7,8-Pentachlorodibenzofuran
1,2,3,7,8-PCDBF
1,2,3,7,8-PeCDF
1,2,3,7,8-Pentachlorodibenzofuran, 13-12C-labeled
3,4,5,11,12-pentachloro-8-oxatricyclo[7.4.0.0²,⁷]trideca-1(13),2,4,6,9,11-hexaene
PCDF 94

keggC:M_C18105
seedM:M_cpd19375
secondary/obsolete/fantasy identifier