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0IF

Summary
Name:2-amino-6-fluorobenzonitrile
Formula:C7 H5 F N2
Formal charge:0
Formula weight:136.126 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
ACDLabs12.012-amino-6-fluorobenzonitrile
OpenEye OEToolkits2.0.72-azanyl-6-fluoranyl-benzenecarbonitrile

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01N#Cc1c(F)cccc1N
InChIInChI1.06InChI=1S/C7H5FN2/c8-6-2-1-3-7(10)5(6)4-9/h1-3H,10H2
InChIKeyInChI1.06IQUNZGOZUJITBJ-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1cccc(F)c1C#N
SMILESCACTVS3.385Nc1cccc(F)c1C#N
SMILES_CANONICALOpenEye OEToolkits2.0.7c1cc(c(c(c1)F)C#N)N
SMILESOpenEye OEToolkits2.0.7c1cc(c(c(c1)F)C#N)N

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PDB entries from 2024-07-10

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