Tetrapentylammonium iodide

C20H44INCAS 2498-20-6425.48 g/mol

Open in Covalent MOL file
N+I−
Quaternary ammonium

Properties

Molecular formula
C20H44IN
Molar mass
425.48 g/mol
Exact mass
425.2518 Da
logP
3.57Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
16

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
2498-20-6
SMILES
CCCCC[N+](CCCCC)(CCCCC)CCCCC.[I-]
InChIKey
FBLZDUAOBOMSNZ-UHFFFAOYSA-M
InChI
InChI=1S/C20H44N.HI/c1-5-9-13-17-21(18-14-10-6-2,19-15-11-7-3)20-16-12-8-4;/h5-20H2,1-4H3;1H/q+1;/p-1

Weigh it out

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

Names and synonyms

6 names
  • 1-Pentanaminium, N,N,N-tripentyl-, iodide (1:1)
  • 1-Pentanaminium, N,N,N-tripentyl-, iodide
  • Tetraamylammonium iodide
  • Tetra-n-pentylammonium iodide
  • Tetra-n-amylammonium iodide
  • Ammonium, tetrapentyl-, iodide

Work with Tetrapentylammonium iodide

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.

Tetrapentylammonium chloride4965-17-7Salt

Similar compounds

Tetrahexylammonium iodide2138-24-194 % similar Tetraheptylammonium iodide3535-83-994 % similar Tetra-n-butylammonium iodide311-28-483 % similar Tetraoctylammonium bromide14866-33-267 % similar Tetradecylammonium bromide14937-42-967 % similar Tetrahexylammonium bromide4328-13-667 % similar Tetraheptylammonium bromide4368-51-867 % similar Tetrapropylammonium iodide631-40-363 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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