RefChem:1085169

dimethyl-[2-[phenyl-[3-(trifluoromethyl)phenyl]methoxy]ethyl]azanium;(E)-4-hydroxy-4-oxobut-2-enoate

Also Known As: Ethylamine, N,N-dimethyl-2-(alpha-(alpha,alpha,alpha-trifluoro-m-tolyl)benzyloxy)-, fumarate|N,N-Dimethyl-2-(alpha-(alpha,alpha,alpha-trifluoro-m-tolyl)benzyloxy)ethylamine fumarate|dimethyl-[2-[phenyl-[3-(trifluoromethyl)phenyl]methoxy]ethyl]azanium; (E)-4-hydroxy-4-oxobut-2-enoate|Ethylamine, N,N-dimethyl-2-[[.alpha.-phenyl-m-(trifluoromethyl)benzyl]oxy]-, fumarate (1:1)

Molecular Formula	C22H24F3NO5
Molecular Weight	439.16064 g/mol
LogP	1.333
Topological Polar Surface Area	91.1 Ų
Hydrogen Bond Donors	2
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	439.16064
Monoisotopic Mass	439.16064
Heavy Atoms	31
Complexity	850.95013

Chemical Identifiers

CAS Number	3215-98-3
SMILES	C[NH+](C)CCOC(C1=CC=CC=C1)C2=CC(=CC=C2)C(F)(F)F.C(=C/C(=O)[O-])\C(=O)O