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4-hydroxy-2,2',3',4',6'-pentachlorobiphenyl

PropertiesImage
MNX_IDMNXM37483 Image of MNXM37483
referencechebi:34413
formulaC12H5Cl5O
global charge0
mol weight342.436
InChIKeyBFEKLMSBXGRXSD-UHFFFAOYSA-N
InChIInChI=1S/C12H5Cl5O/c13-7-3-5(18)1-2-6(7)10-8(14)4-9(15)11(16)12(10)17/h1-4,18H
SMILESOC1=CC=C(C2=C(Cl)C=C(Cl)C(Cl)=C2Cl)C(Cl)=C1
MNX internals
InChI (mnx)InChI=1/C12H5Cl5O/c13-7-3-5(18)1-2-6(7)10-8(14)4-9(15)11(16)12(10)17/h1-4,18H Image of MNXM37483
SMILES (mnx)[CH:1]1=[CH:2][C:6]([C:10]2=[C:12]([Cl:17])[C:11]([Cl:16])=[C:9]([Cl:15])[CH:4]=[C:8]2[Cl:14])=[C:7]([Cl:13])[CH:3]=[C:5]1[OH:18]
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

CHEBI:34413
chebi:34413
BFEKLMSBXGRXSD-UHFFFAOYSA-N 		4-hydroxy-2,2',3',4',6'-pentachlorobiphenyl
2,2',3',4',6'-Pentachloro-4-biphenylol
2,2',3',4',6'-pentachloro[1,1'-biphenyl]-4-ol
2,2',3',4',6'-pentachlorobiphenyl-4-ol
3-chloro-4-(2,3,4,6-tetrachlorophenyl)phenol
4-Hydroxy-2,2',3',4',6'-pentachlorobiphenyl

seed.compound:cpd10073
seedM:cpd10073
BFEKLMSBXGRXSD-UHFFFAOYSA-N 		2,2',3',4',6'-Pentachloro-4-biphenylol
4-Hydroxy-2,2',3',4',6'-pentachlorobiphenyl

kegg.compound:C14374
keggC:C14374
BFEKLMSBXGRXSD-UHFFFAOYSA-N 		4-Hydroxy-2,2',3',4',6'-pentachlorobiphenyl
2,2',3',4',6'-Pentachloro-4-biphenylol

keggC:M_C14374
seedM:M_cpd10073 		secondary/obsolete/fantasy identifier