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XDH

Summary
Name:4,4'-propane-2,2-diylbis(2,6-dichlorophenol)
Formula:C15 H12 Cl4 O2
Formal charge:0
Formula weight:366.067 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014,4'-propane-2,2-diylbis(2,6-dichlorophenol)
OpenEye OEToolkits1.7.02,6-dichloro-4-[2-(3,5-dichloro-4-hydroxy-phenyl)propan-2-yl]phenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Clc1cc(cc(Cl)c1O)C(c2cc(Cl)c(O)c(Cl)c2)(C)C
SMILES_CANONICALCACTVS3.370CC(C)(c1cc(Cl)c(O)c(Cl)c1)c2cc(Cl)c(O)c(Cl)c2
SMILESCACTVS3.370CC(C)(c1cc(Cl)c(O)c(Cl)c1)c2cc(Cl)c(O)c(Cl)c2
SMILES_CANONICALOpenEye OEToolkits1.7.0CC(C)(c1cc(c(c(c1)Cl)O)Cl)c2cc(c(c(c2)Cl)O)Cl
SMILESOpenEye OEToolkits1.7.0CC(C)(c1cc(c(c(c1)Cl)O)Cl)c2cc(c(c(c2)Cl)O)Cl
InChIInChI1.03InChI=1S/C15H12Cl4O2/c1-15(2,7-3-9(16)13(20)10(17)4-7)8-5-11(18)14(21)12(19)6-8/h3-6,20-21H,1-2H3
InChIKeyInChI1.03KYPYTERUKNKOLP-UHFFFAOYSA-N

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PDB entries from 2024-04-24

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