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5AN

Summary
Name:3,5-DIFLUOROANILINE
Formula:C6 H5 F2 N
Formal charge:0
Formula weight:129.107 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043,5-difluoroaniline
OpenEye OEToolkits1.5.03,5-difluoroaniline

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Fc1cc(N)cc(F)c1
SMILES_CANONICALCACTVS3.341Nc1cc(F)cc(F)c1
SMILESCACTVS3.341Nc1cc(F)cc(F)c1
SMILES_CANONICALOpenEye OEToolkits1.5.0c1c(cc(cc1F)F)N
SMILESOpenEye OEToolkits1.5.0c1c(cc(cc1F)F)N
InChIInChI1.03InChI=1S/C6H5F2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2
InChIKeyInChI1.03KQOIBXZRCYFZSO-UHFFFAOYSA-N

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PDB entries from 2024-08-07

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