1-Hexanaminium, N,N,N-trimethyl-chloride | SBID = 1038 | Compound | Pubchem logo

Struc Structure

Molecular Properties

Interactions: 6
PubChem TPSA/Å2: 0.0
Ertl TPSA/Å2:
Hydrophilicity (PubChem XLogP):
Hydrophilicity (Cheng XLogP3):
Charge: 0.0
Number of H-Bond Donors: 0.0
Number of H-Bond Acceptors: 1.0
Number of Stereogenic Bonds (E/Z): 0.0
Number of Stereogenic Atoms (R/S): 0.0
3D Volume/Å3:
Sum Formula: C9H22ClN
M / g/mol: 179.73
Complexity: 71.0
Number of Conformers: 0.0

Identifiers

  • Tags: typical guest, charged
  • Name: 1-Hexanaminium, N,N,N-trimethyl-chloride
  • Preferred Abbreviation: N-Hexyltrimethylammonium chloride
  • IUPAC Name: hexyl(trimethyl)azanium;chloride
  • CAS: 29801-86-3
  • CID: 11789802
  • InChiKey: FZCCKDYTOZQJJR-UHFFFAOYSA-M
  • InChi: InChI=1S/C9H22N.ClH/c1-5-6-7-8-9-10(2,3)4;/h5-9H2,1-4H3;1H/q+1;/p-1
  • CanoSmiles: CCCCCC[N+](C)(C)C.[Cl-]
  • IsoSmiles: CCCCCC[N+](C)(C)C.[Cl-]