Tetrahexyl ammonium bromide

CAT: 0127-OR4672-01Size: 1 gDry Ice: NoHazardous: No

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CAS Number

4328-13-6

Synonyms

N, N, N-Trihexyl-1-hexanaminium bromide

MDL Number

MFCD00011858

Purity

98%

Smiles

[Br-].CCCCCC[N+] (CCCCCC) (CCCCCC) CCCCCC

Chemical Information

Tetrahexylammonium bromide

CAS Number	4328-13-6
PubChem CID	78026
IUPAC Name	tetrahexylazanium bromide
Molecular Formula	C24H52BrN
Molecular Weight	434.6
Topological Polar Surface Area	0
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	20
Heavy Atom Count	26
Formal Charge	0
Complexity	195

SMILES

CCCCCC[N+](CCCCCC)(CCCCCC)CCCCCC.[Br-]

InChI

InChI=1S/C24H52N.BrH/c1-5-9-13-17-21-25(22-18-14-10-6-2,23-19-15-11-7-3)24-20-16-12-8-4;/h5-24H2,1-4H3;1H/q+1;/p-1

InChIKey

SYZCZDCAEVUSPM-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 4328-13-6

CID: 78026

Formula: C24H52BrN

MW: 434.6

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	434.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	20
Exact Mass	433.32831
Monoisotopic Mass	433.32831
Topological Polar Surface Area	0 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	195
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	2
Compound Is Canonicalized	Yes

Catalog	Name
OR1022579	Tetradecyl trimethyl ammonium bromide
OR4675-01	Tetraoctyl ammonium bromide
OR72821-01	Tetrakis (decyl) ammonium bromide
OR1030754	Tetrakis (decyl) ammonium bromide
OR10054-01	Tetra (but-1-yl) ammonium bromide
OR22439	(2-cyanoethyl) (dimethyl) ammonium bromide
OR10058	Tetrakis (prop-1-yl) ammonium bromide
OR28401	[amino (prop-2-ynylthio) methylidene]ammonium bromide
OR26339	(2,2-dimethyl-3-oxobutyl) (trimethyl) ammonium bromide
OR1030000-01	Ammonium, diethyl (2-hydroxyethyl) methyl-, bromide, benzilate (ester)

Catalog	Name
TRC-A633820-5G	Ammonium Bromide
1041570 100	Dodecyl Trimethyl Ammonium Bromide for Synthesis (Lauryltrimethyl Ammonium Bromide)
CB0105	Cetyldimethylethyl ammonium bromide (Ethylhexadecyldimethylammonium bromide)
HY-Y0306S	Ammonium bromide-d4
sc-319818	Ammonium bromide-79Br
DB0431	Dodecyltrimethyl ammonium bromide
C063-500G	Cetyltrimethyl Ammonium Bromide
162630	Ammonium-15N Bromide
GX4036-1kg	Ammonium bromide, 99+%
sc-300201	Ammonium-d4 bromide