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8H8

Summary
Name:2-fluoro-4-hydroxybenzonitrile
Formula:C7 H4 F N O
Formal charge:0
Formula weight:137.111 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-fluoro-4-hydroxybenzonitrile
OpenEye OEToolkits1.9.22-fluoranyl-4-oxidanyl-benzenecarbonitrile

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01Fc1c(C#N)ccc(O)c1
InChIInChI1.03InChI=1S/C7H4FNO/c8-7-3-6(10)2-1-5(7)4-9/h1-3,10H
InChIKeyInChI1.03REIVHYDACHXPNH-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Oc1ccc(C#N)c(F)c1
SMILESCACTVS3.385Oc1ccc(C#N)c(F)c1
SMILES_CANONICALOpenEye OEToolkits1.9.2c1cc(c(cc1O)F)C#N
SMILESOpenEye OEToolkits1.9.2c1cc(c(cc1O)F)C#N

217705

PDB entries from 2024-03-27

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