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140-72-7 | Pyridinium, 1-hexadecyl-, bromide (1:1)
CAS No: 140-72-7 Catalog No: AG001BXD MDL No:MFCD00011988
Product Description
Catalog Number:
AG001BXD
Chemical Name:
Pyridinium, 1-hexadecyl-, bromide (1:1)
CAS Number:
140-72-7
Molecular Formula:
C21H38BrN
Molecular Weight:
384.4371
MDL Number:
MFCD00011988
IUPAC Name:
1-hexadecylpyridin-1-ium;bromide
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
InChI Key:
DVBJBNKEBPCGSY-UHFFFAOYSA-M
SMILES:
CCCCCCCCCCCCCCCC[n+]1ccccc1.[Br-]
EC Number:
205-428-3
UNII:
O77BKZ14DE
NSC Number:
8495
Properties
Complexity:
208
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
383.219g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
384.446g/mol
Monoisotopic Mass:
383.219g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
3.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Literature
| Title | Journal |
|---|---|
| Synthesis, self-aggregation and biological properties of alkylphosphocholine and alkylphosphohomocholine derivatives of cetyltrimethylammonium bromide, cetylpyridinium bromide, benzalkonium bromide (C16) and benzethonium chloride. | European journal of medicinal chemistry 20130801 |
| Adsorption of phenanthrene by quaternary ammonium surfactant modified peat and the mechanism involved. | Water science and technology : a journal of the International Association on Water Pollution Research 20120101 |
| Lipophosphonoxins: new modular molecular structures with significant antibacterial properties. | Journal of medicinal chemistry 20111124 |
| Synthesis and antibacterial activity study of a novel class of cationic anthraquinone analogs. | Bioorganic & medicinal chemistry 20110101 |
| Incorporating intermicellar interactions in the fitting of SANS data from cationic wormlike micelles. | Langmuir : the ACS journal of surfaces and colloids 20060718 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Synthesis and antibacterial properties of novel hydrolyzable cationic amphiphiles. Incorporation of multiple head groups leads to impressive antibacterial activity. | Journal of medicinal chemistry 20050602 |
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