(S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium | SBID = 2428 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 0.0
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): 0.54
Charge: 2.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 0.0
Number of Stereogenic Bonds (E/Z):
Number of Stereogenic Atoms (R/S):
3D Volume/Å3:
Sum Formula: C9H22N2++
M / g/mol: 158.28438
Complexity:
Number of Conformers:

Identifiers

  • Tags: typical guest
  • Name: (S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium
  • Preferred Abbreviation: (S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium
  • IUPAC Name:
  • CAS:
  • CID: -1029
  • InChiKey: PELQQERYNSAGTM-UHFFFAOYSA-N
  • InChi: InChI=1S/C9H22N2/c1-9-8-10(2,3)6-7-11(9,4)5/h9H,6-8H2,1-5H3/q+2
  • CanoSmiles: C[C@H]1C[N+](C)(C)CC[N+]1(C)C
  • IsoSmiles: C[N+]1(C)CC[N+](C)(C)[C@@H](C)C1