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Tetraamylammonium iodide

CAT: 0013-GTR19244716-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19244716-01Size:100 mg
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Description
Tetraamylammonium iodide is a biochemical reagent that can be used as a biomaterial for life science related research and as a sulfonylation reagent for organic synthesis and drug discovery.
CAS Number
2498-20-6
Smiles
[I-].CCCCC[N+] (CCCCC) (CCCCC) CCCCC
Molecular Formula
C20H44IN
Molecular Weight
425.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Tetrapentylammonium iodide
CAS Number2498-20-6
PubChem CID17248
IUPAC Nametetrapentylazanium iodide
Molecular FormulaC20H44IN
Molecular Weight425.5
Topological Polar Surface Area0
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count16
Heavy Atom Count22
Formal Charge0
Complexity155
SMILES
CCCCC[N+](CCCCC)(CCCCC)CCCCC.[I-]
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
InChIKey
FBLZDUAOBOMSNZ-UHFFFAOYSA-M
Chemical Structure
2D Structure
2D structure of Tetrapentylammonium iodide
CAS: 2498-20-6
CID: 17248
Formula: C20H44IN
MW: 425.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight425.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count1
Rotatable Bond Count16
Exact Mass425.25185
Monoisotopic Mass425.25185
Topological Polar Surface Area0 Ų
Heavy Atom Count22
Formal Charge0
Complexity155
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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