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HX8

Summary
Name:4-phenoxyphenol
Formula:C12 H10 O2
Formal charge:0
Formula weight:186.207 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.014-phenoxyphenol
OpenEye OEToolkits2.0.64-phenoxyphenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c2cccc(Oc1ccc(cc1)O)c2
InChIInChI1.03InChI=1S/C12H10O2/c13-10-6-8-12(9-7-10)14-11-4-2-1-3-5-11/h1-9,13H
InChIKeyInChI1.03ZSBDGXGICLIJGD-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ccc(Oc2ccccc2)cc1
SMILESCACTVS3.385Oc1ccc(Oc2ccccc2)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.6c1ccc(cc1)Oc2ccc(cc2)O
SMILESOpenEye OEToolkits2.0.6c1ccc(cc1)Oc2ccc(cc2)O

223790

PDB entries from 2024-08-14

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