Cetylpyridinium bromide hydrate

Base Information

• Chemical Name: Cetylpyridinium bromide hydrate
• CAS No.: 202869-92-9
• Molecular Formula: C21H38N.Br.H2O
• Molecular Weight: 402.45200
• European Community (EC) Number: 693-726-8
• ChEMBL ID: CHEMBL1710321
• DSSTox Substance ID: DTXSID60583485
• Mol file: 202869-92-9.mol

Synonyms:Cetylpyridinium bromide hydrate;202869-92-9;1-hexadecylpyridin-1-ium;bromide;hydrate;(1-Hexadecyl)pyridinium bromide monohydrate;CETYLPYRIDINIUM BROMIDE HYDRATE 98;MLS002207151;SCHEMBL1922334;CHEMBL1710321;DTXSID60583485;cetylpyridinium bromide monohydrate;cetyl-pyridinium bromide monohydrate;MFCD00150003;Cetylpyridinium bromide hydrate, 98%;AKOS024390850;AS-10439;SMR001306729;(1-hexadecyl) pyridinium bromide monohydrate;1-Hexadecylpyridin-1-ium bromide--water (1/1/1);Pyridinium, 1-hexadecyl-, bromide, hydrate (1:1:1)

Chemical Property of Cetylpyridinium bromide hydrate

Chemical Property:

• Melting Point: 67-71 °C (lit.)
• PSA: 13.11000
• LogP: 3.39510
• Storage Temp.: Store below +30°C.
• Sensitive.: Hygroscopic
• Solubility.: ethanol: soluble5%, hazy (Pale beige)
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 15
• Exact Mass: 401.22933
• Heavy Atom Count: 24
• Complexity: 208

Purity/Quality:

98%,99%, ^*data from raw suppliers

Cetylpyridinium bromide hydrate 98% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T+
• Statements: 22-26-36/37/38
• Safety Statements: 26-28-36/37-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCCCC[N+]1=CC=CC=C1.O.[Br-]
• Uses: Cetylpyridinium bromide hydrate was used in the modification of the zeolite.