chempirical

Tetrabutylammonium nitrate

C16H36N2O3CAS 1941-27-1304.47 g/mol

Open in Covalent MOL file
N+ON+O−O−
NitroQuaternary ammonium

Properties

Molecular formula
C16H36N2O3
Molar mass
304.47 g/mol
Exact mass
304.2726 Da
logP
4.76Crippen estimate
Polar surface area
66.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
12

Identifiers

CAS number
1941-27-1
SMILES
CCCC[N+](CCCC)(CCCC)CCCC.O=[N+]([O-])[O-]
InChIKey
QHOKENWFMZXSEU-UHFFFAOYSA-N
InChI
InChI=1S/C16H36N.NO3/c1-5-9-13-17(14-10-6-2,15-11-7-3)16-12-8-4;2-1(3)4/h5-16H2,1-4H3;/q+1;-1

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

5 names
  • 1-Butanaminium, N,N,N-tributyl-, nitrate (1:1)
  • Ammonium, tetrabutyl-, nitrate
  • 1-Butanaminium, N,N,N-tributyl-, nitrate
  • NSC 221165
  • Tetra-n-butylammonium nitrate

Work with Tetrabutylammonium nitrate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Tetraethylammonium nitrate1941-26-054 % similar Tetrabutylammonium chloride1112-67-052 % similar Tetrabutylammonium bromide1643-19-252 % similar Tetrabutylammonium hydroxide2052-49-552 % similar Tetra-N-butylammonium iodide311-28-452 % similar Tetrabutylammonium borohydride33725-74-552 % similar Tetra-N-butylammonium fluoride429-41-452 % similar Tetrabutylammonium perchlorate1923-70-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook