1-Hexadecanaminium,...

1-Hexadecanaminium,N-(carboxymethyl)-N,N-dimethyl-, bromide (1:1)(CAS No. 5466-51-3)

1-Hexadecanaminium,N-(carboxymethyl)-N,N-dimethyl-, bromide (1:1)(CAS No. 5466-51-3)

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1-Hexadecanaminium,N-(carboxymethyl)-N,N-dimethyl-, bromide (1:1) 5466-51-3 98%

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Details:

【Name】
1-Hexadecanaminium,N-(carboxymethyl)-N,N-dimethyl-, bromide (1:1)
【CAS Registry number】
5466-51-3
【Synonyms】
1-Hexadecanaminium,N-(carboxymethyl)-N,N-dimethyl-, bromide (9CI)
(N-Hexadecyl-N,N-dimethylammonio)aceticacid bromide
Cetyldimethyl(carboxymethyl)ammonium bromide
Hexadecylbetainebromide
【Molecular Formula】
C20H42 N O2 . Br (Products with the same molecular formula)
【Molecular Weight】
408.45698
【Inchi】
InChI=1S/C20H41NO2.BrH/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-21(2,3)19-20(22)23;/h4-19H2,1-3H3;1H
【Canonical SMILES】
CCCCCCCCCCCCCCCC[N+](C)(C)CC(=O)O.[Br-]
Chemical and Physical Properties
【Computed Properties】
Molecular Weight:408.45698 [g/mol]
Molecular Formula:C20H42BrNO2
H-Bond Donor:1
H-Bond Acceptor:3
Rotatable Bond Count:17
Exact Mass:407.239892
MonoIsotopic Mass:407.239892
Topological Polar Surface Area:37.3
Heavy Atom Count:24
Formal Charge:0
Complexity:277
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

 

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