1-Dodecanaminium, N,N-dimethyl-N-(2-phenoxyethyl)-, bromide


Chemical Name: 1-Dodecanaminium, N,N-dimethyl-N-(2-phenoxyethyl)-, bromide
CAS Number: 538-71-6
Product Number: AG00IKEP(AGN-PC-0JK9QT)
Synonyms:
MDL No:
Molecular Formula: C22H40BrNO
Molecular Weight: 414.4631

Identification/Properties


Properties
MP:
115 - 119°C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
414.472g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
15
Exact Mass:
413.229g/mol
Monoisotopic Mass:
413.229g/mol
Topological Polar Surface Area:
9.2A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
271
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
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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