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Cetylpyridinium chloride - meets USP testing specifications, high purity , CAS No.6004-24-6

In stock
Item Number
C433049
Grouped product items
SKU Size
Availability
Price Qty
C433049-100g
100g
2
$77.90
C433049-500g
500g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$279.90

Basic Description

Synonyms Hexadecylpyridinium chloride monohydrate | PYRIDINIUM, 1-HEXADECYL-, CHLORIDE, MONOHYDRATE | Cetylpyridinium chloride monohydrate | 1-Hexadecylpyridinium chloride monohydrate | 1-hexadecylpyridin-1-ium chloride hydrate | Ceepryn
Specifications & Purity PharmPure™, USP
Grade PharmPure™, USP
Product Description

Application

Cetylpyridinium chloride is used to study the mechanisms of bacterial and virus inactivation by cationic quaternary ammonium detergents.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Pyridines and derivatives
Subclass Pyridinium derivatives
Intermediate Tree Nodes Not available
Direct Parent Pyridinium derivatives
Alternative Parents Heteroaromatic compounds  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Organic chloride salts  Hydrocarbon derivatives  
Molecular Framework Aromatic heteromonocyclic compounds
Substituents Pyridinium - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organonitrogen compound - Aromatic heteromonocyclic compound
Description This compound belongs to the class of organic compounds known as pyridinium derivatives. These are compounds containing a pyridinium ring, which is the cationic form of pyridine.
External Descriptors hydrate

Associated Targets(Human)

Caco-2 (12174 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SLCO1B1 Tchem Solute carrier organic anion transporter family member 1B1 (2672 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
SLCO1B3 Tchem Solute carrier organic anion transporter family member 1B3 (2517 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
OPRD1 Tclin Opioid receptors; mu & delta (1530 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
RAD52 Tchem DNA repair protein RAD52 homolog (856 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
HSPD1 Tbio HSP60/HSP10 (366 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
TST Tchem Thiosulfate sulfurtransferase (144 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Mc4r Melanocortin receptor 4 (1205 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
rep Replicase polyprotein 1ab (378 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
groL GroEL/GroES (1042 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
groEL 60 kDa chaperonin (64 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name 1-hexadecylpyridin-1-ium;chloride;hydrate
INCHI InChI=1S/C21H38N.ClH.H2O/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;1H2/q+1;;/p-1
InChIKey NFCRBQADEGXVDL-UHFFFAOYSA-M
Smiles CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.O.[Cl-]
Isomeric SMILES CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.O.[Cl-]
WGK Germany 3
RTECS UU5075000
UN Number 2811
Molecular Weight 358
Beilstein 3578606
Reaxy-Rn 17134807
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=17134807&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

1 results found

Lot Number Certificate Type Date Item
D2416027 Certificate of Analysis Apr 24, 2024 C433049

Chemical and Physical Properties

Melt Point(°C) 81°C-86°C
Molecular Weight 358.000 g/mol
XLogP3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 15
Exact Mass 357.28 Da
Monoisotopic Mass 357.28 Da
Topological Polar Surface Area 4.900 Ų
Heavy Atom Count 24
Formal Charge 0
Complexity 208.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 3

Citations of This Product

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