N,N'-(1,4-phenylenebis(methylene))bis(2-azidoethan-1-aminium) chloride | SBID = 2616 | Compound | Custom Molecule

Struc Structure

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Molecular Properties

Interactions: 1
PubChem TPSA/Å2:
Ertl TPSA/Å2: 132.72
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3): 4.07
Charge: 0.0
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: C12H20Cl2N8
M / g/mol: 347.2468
Complexity:
Number of Conformers:

Identifiers

  • Tags: guest
  • Name: N,N'-(1,4-phenylenebis(methylene))bis(2-azidoethan-1-aminium) chloride
  • Preferred Abbreviation: N,N'-(1,4-phenylenebis(methylene))bis(2-azidoethan-1-aminium) chloride
  • IUPAC Name:
  • CAS:
  • CID: -1163
  • InChiKey: UEEDYYYEYXRESY-UHFFFAOYSA-N
  • InChi: InChI=1S/C12H18N8.2ClH/c13-19-17-7-5-15-9-11-1-2-12(4-3-11)10-16-6-8-18-20-14;;/h1-4,15-16H,5-10H2;2*1H
  • CanoSmiles: [N-]=[N+]=NCC[NH2+]Cc1ccc(cc1)C[NH2+]CCN=[N+]=[N-].[Cl-].[Cl-]
  • IsoSmiles: [N-]=[N+]=NCC[NH2+]CC1=CC=C(C[NH2+]CCN=[N+]=[N-])C=C1.[Cl-].[Cl-]