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297

Summary
Name:dodecane-1,12-diamine
Formula:C12 H28 N2
Formal charge:0
Formula weight:200.364 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.04dodecane-1,12-diamine
OpenEye OEToolkits1.5.0dodecane-1,12-diamine

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04NCCCCCCCCCCCCN
SMILES_CANONICALCACTVS3.341NCCCCCCCCCCCCN
SMILESCACTVS3.341NCCCCCCCCCCCCN
SMILES_CANONICALOpenEye OEToolkits1.5.0C(CCCCCCN)CCCCCN
SMILESOpenEye OEToolkits1.5.0C(CCCCCCN)CCCCCN
InChIInChI1.03InChI=1S/C12H28N2/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-14H2
InChIKeyInChI1.03QFTYSVGGYOXFRQ-UHFFFAOYSA-N

219140

PDB entries from 2024-05-01

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