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

5BR

Summary
Name:1-BROMOPENTANE
Formula:C5 H11 Br
Formal charge:0
Formula weight:151.045 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.041-bromopentane
OpenEye OEToolkits1.5.01-bromopentane

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04BrCCCCC
SMILES_CANONICALCACTVS3.341CCCCCBr
SMILESCACTVS3.341CCCCCBr
SMILES_CANONICALOpenEye OEToolkits1.5.0CCCCCBr
SMILESOpenEye OEToolkits1.5.0CCCCCBr
InChIInChI1.03InChI=1S/C5H11Br/c1-2-3-4-5-6/h2-5H2,1H3
InChIKeyInChI1.03YZWKKMVJZFACSU-UHFFFAOYSA-N

226262

PDB entries from 2024-10-16

PDB statisticsPDBj update infoContact PDBjnumon