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A1ISU

Summary
Name:3,5-bis(chloranyl)aniline
Synonyms:3,5-dichloroaniline
Formula:C6 H5 Cl2 N
Formal charge:0
Formula weight:162.017 Da
Component type:non-polymer

Chemical Identifiers

ProgramVersionName
OpenEye OEToolkits2.0.73,5-bis(chloranyl)aniline

Chemical Descriptors

TypeProgramVersionDescriptor
InChIInChI1.06InChI=1S/C6H5Cl2N/c7-4-1-5(8)3-6(9)2-4/h1-3H,9H2
InChIKeyInChI1.06UQRLKWGPEVNVHT-UHFFFAOYSA-N
SMILES_CANONICALCACTVS3.385Nc1cc(Cl)cc(Cl)c1
SMILESCACTVS3.385Nc1cc(Cl)cc(Cl)c1
SMILES_CANONICALOpenEye OEToolkits2.0.7c1c(cc(cc1Cl)Cl)N
SMILESOpenEye OEToolkits2.0.7c1c(cc(cc1Cl)Cl)N

247536

PDB entries from 2026-01-14

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