Loading
PDBj
MenuPDBj@FacebookPDBj@TwitterPDBj@YouTubewwPDB FoundationwwPDB
RCSB PDBPDBeBMRBAdv. SearchSearch help

BCF

Summary
Name:1-chloro-2,3,4,5,6-pentafluorobenzene
Formula:C6 Cl F5
Formal charge:0
Formula weight:202.509 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.041-chloro-2,3,4,5,6-pentafluorobenzene
OpenEye OEToolkits1.5.01-chloro-2,3,4,5,6-pentafluoro-benzene

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04Fc1c(F)c(F)c(F)c(Cl)c1F
SMILES_CANONICALCACTVS3.341Fc1c(F)c(F)c(Cl)c(F)c1F
SMILESCACTVS3.341Fc1c(F)c(F)c(Cl)c(F)c1F
SMILES_CANONICALOpenEye OEToolkits1.5.0c1(c(c(c(c(c1F)F)Cl)F)F)F
SMILESOpenEye OEToolkits1.5.0c1(c(c(c(c(c1F)F)Cl)F)F)F
InChIInChI1.03InChI=1S/C6ClF5/c7-1-2(8)4(10)6(12)5(11)3(1)9
InChIKeyInChI1.03KGCDGLXSBHJAHZ-UHFFFAOYSA-N

222415

PDB entries from 2024-07-10

PDB statisticsPDBj update infoContact PDBjnumon