Hexadecylpyridinium bromide

CAT: 0931-TSH-00435-01Size: 10 gDry Ice: NoHazardous: No

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CAT#:0931-TSH-00435-01Size:10 g

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CAS Number

140-72-7

Bioactivity

Hexadecylpyridinium bromide is a reagent used in biochemical reactions.

Smiles

[Br-].C=1C=C[N+](=CC1)CCCCCCCCCCCCCCCC

Molecular Formula

C21H38BrN

Molecular Weight

384.44

Shipping Conditions

Ice Packs

Storage Temperature

-20°C

Chemical Information

Cetylpyridinium Bromide

Cetylpyridinium bromide is a pyridinium salt that has N-hexadecylpyridinium as the cation and bromide as the anion. It has a role as a surfactant, an antiseptic drug and an EC 2.7.11.18 (myosin-light-chain kinase) inhibitor. It is a bromide salt and a pyridinium salt.

CAS Number	140-72-7
PubChem CID	8816
IUPAC Name	1-hexadecylpyridin-1-ium bromide
Molecular Formula	C21H38BrN
Molecular Weight	384.4
Topological Polar Surface Area	3.9
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	15
Heavy Atom Count	23
Formal Charge	0
Complexity	208

SMILES

CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.[Br-]

InChI

InChI=1S/C21H38N.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-16-19-22-20-17-15-18-21-22;/h15,17-18,20-21H,2-14,16,19H2,1H3;1H/q+1;/p-1

InChIKey

DVBJBNKEBPCGSY-UHFFFAOYSA-M

Chemical Structure

2D Structure

CAS: 140-72-7

CID: 8816

Formula: C21H38BrN

MW: 384.4

Interactive 3D Structure

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View on PubChem Raw 3D data

Computed Properties

Property	Value
Molecular Weight	384.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	15
Exact Mass	383.21876
Monoisotopic Mass	383.21876
Topological Polar Surface Area	3.9 Å²
Heavy Atom Count	23
Formal Charge	0
Complexity	208
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

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Alternative Products

Catalog	Name
H036-25G	Hexadecylpyridinium bromide
HY-W011038-01	Hexadecylpyridinium (bromide)
OR1044133-01	Hexadecylpyridinium bromide hydrate
H9160-01	1-Hexadecylpyridinium bromide
TRC-N211251-10MG	n-Hexadecylpyridinium-d5 Bromide
OR9585-01	Hexadecylpyridinium chloride
07905-05	Hexadecylpyridinium Chloride Monohydrate
sc-290101	4-Carbamoyl-1-hexadecylpyridinium Chloride
29309654-500g	Hexadecyltrimethylammonium bromide (Cetyltrimethylammonium bromide)
CB0105	Cetyldimethylethyl ammonium bromide (Ethylhexadecyldimethylammonium bromide)

Hexadecylpyridinium bromide

Chemical Information

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