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1AN

Summary
Name:2-FLUOROANILINE
Formula:C6 H6 F N
Formal charge:0
Formula weight:111.117 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.042-fluoroaniline
OpenEye OEToolkits1.5.02-fluoroaniline

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Fc1ccccc1N
SMILES_CANONICALCACTVS3.341Nc1ccccc1F
SMILESCACTVS3.341Nc1ccccc1F
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc(c(c1)N)F
SMILESOpenEye OEToolkits1.5.0c1ccc(c(c1)N)F
InChIInChI1.03InChI=1S/C6H6FN/c7-5-3-1-2-4-6(5)8/h1-4H,8H2
InChIKeyInChI1.03FTZQXOJYPFINKJ-UHFFFAOYSA-N

217705

PDB entries from 2024-03-27

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