chempirical

Tetraethylammonium hydrogen sulfate

C8H21NO4SCAS 16873-13-5227.32 g/mol

Open in Covalent MOL file
N+OSOO−OH
Quaternary ammonium

Properties

Molecular formula
C8H21NO4S
Molar mass
227.32 g/mol
Exact mass
227.1191 Da
logP
0.89Crippen estimate
Polar surface area
77.4 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
4

Identifiers

CAS number
16873-13-5
SMILES
CC[N+](CC)(CC)CC.O=S(=O)([O-])O
InChIKey
CREVBWLEPKAZBH-UHFFFAOYSA-M
InChI
InChI=1S/C8H20N.H2O4S/c1-5-9(6-2,7-3)8-4;1-5(2,3)4/h5-8H2,1-4H3;(H2,1,2,3,4)/q+1;/p-1

Weigh it out

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

Names and synonyms

4 names
  • Ethanaminium, N,N,N-triethyl-, hydrogen sulfate (1:1)
  • Ammonium, tetraethyl-, sulfate (1:1)
  • Ethanaminium, N,N,N-triethyl-, hydrogen sulfate
  • Tetraethylammonium bisulfate

Work with Tetraethylammonium hydrogen sulfate

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

Tetrapropylammonium hydrogen sulfate56211-70-263 % similar Tetrabutylammonium hydrogen sulfate32503-27-859 % similar Tetramethylammonium hydrogen sulfate80526-82-558 % similar Tetrahexylammonium hydrogen sulfate32503-34-755 % similar Tetramethylammonium hydrogen sulfate monohydrate103812-00-652 % similar Sulfuric acid, sodium salt15124-09-150 % similar Potassium bisulfate7646-93-750 % similar Sodium bisulfate7681-38-150 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook