Tetraethylammonium hydrogen sulfate

C8H21NO4SCAS 16873-13-5227.32 g/mol

Open in Covalent MOL file
N+OSOO−HO
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

Hazards

Warning
Irritant (GHS07)

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

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

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

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Tetraethylammonium bromide71-91-0Salt Tetraethylammonium chloride56-34-8Salt Tetraethylammonium iodide68-05-3Salt Tetraethylammonium hydroxide77-98-5Salt Tetraethylammonium perfluorooctanesulfonate56773-42-3Salt Tetraethylammonium tetrafluoroborate429-06-1Salt Tetraethylammonium p-toluenesulfonate733-44-8Salt Tetraethylammonium trifluoromethanesulfonate35895-69-3Salt Tetraethylammonium hexafluorophosphate429-07-2Salt Tetraethylammonium nitrate1941-26-0Salt Tetraethylammonium perchlorate2567-83-1Salt Tetraethylammonium acetate1185-59-7Salt

Similar compounds

Tetrapropylammonium hydrogen sulfate56211-70-263 % similar Tetrabutylammonium hydrogen sulfate32503-27-859 % similar Tetramethylammonium hydrogen sulphate80526-82-558 % similar Tetrahexylammonium hydrogen sulfate32503-34-755 % similar Tetramethylammonium hydrogen sulfate monohydrate103812-00-652 % similar Basic copper sulfate1344-73-650 % similar Sulfuric acid, sodium salt15124-09-150 % similar Potassium bisulfate7646-93-750 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook