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H3Z

Summary
Name:4-propan-2-ylphenol
Formula:C9 H12 O
Formal charge:0
Formula weight:136.191 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.64-propan-2-ylphenol

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.03InChI=1S/C9H12O/c1-7(2)8-3-5-9(10)6-4-8/h3-7,10H,1-2H3
InChIKeyInChI1.03YQUQWHNMBPIWGK-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385CC(C)c1ccc(O)cc1
SMILESCACTVS3.385CC(C)c1ccc(O)cc1
SMILES_CANONICALOpenEye OEToolkits2.0.6CC(C)c1ccc(cc1)O
SMILESOpenEye OEToolkits2.0.6CC(C)c1ccc(cc1)O

247947

PDB entries from 2026-01-21

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