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V6P

Summary
Name:3-phenoxyphenol
Formula:C12 H10 O2
Formal charge:0
Formula weight:186.207 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.013-phenoxyphenol
OpenEye OEToolkits2.0.73-phenoxyphenol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1c(cccc1O)Oc2ccccc2
InChIInChI1.03InChI=1S/C12H10O2/c13-10-5-4-8-12(9-10)14-11-6-2-1-3-7-11/h1-9,13H
InChIKeyInChI1.03HBUCPZGYBSEEHF-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1cccc(Oc2ccccc2)c1
SMILESCACTVS3.385Oc1cccc(Oc2ccccc2)c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1ccc(cc1)Oc2cccc(c2)O
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)Oc2cccc(c2)O

222926

数据于2024-07-24公开中

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