Catalog Number |
ACM75222490 |
CAS |
75222-49-0 |
Structure |
|
Synonyms |
N,N,N-Triethyl-1-eicosanaminiumbromide |
IUPAC Name |
Triethyl(icosyl)ammonium bromide |
Molecular Weight |
462.6 |
Molecular Formula |
C26H56BrN |
Canonical SMILES |
CCCCCCCCCCCCCCCCCCCC[N+](CC)(CC)CC.[Br-] |
InChI |
InChI=1S/C26H56N.BrH/c1-5-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27(6-2,7-3)8-4;/h5-26H2,1-4H3;1H/q+1;/p-1 |
InChI Key |
SMHLVTWLIORUSV-UHFFFAOYSA-M |
Purity |
98%+ |
Complexity |
261 |
Covalently-Bonded Unit Count |
2 |
Defined Atom Stereocenter Count |
0 |
Exact Mass |
461.35961 |
Heavy Atom Count |
28 |
Hydrogen Bond Acceptor Count |
1 |
Hydrogen Bond Donor Count |
0 |
Monoisotopic Mass |
461.35961 |
Rotatable Bond Count |
22 |
Topological Polar Surface Area |
0 Ų |
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