Benzenemethanaminium,N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-, benzoate


Chemical Name: Benzenemethanaminium,N-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]-N,N-diethyl-, benzoate
CAS Number: 3734-33-6
Product Number: AG00I7CS(AGN-PC-0RDRXN)
Synonyms:
MDL No:
Molecular Formula: C28H34N2O3
Molecular Weight: 446.5812

Identification/Properties


Computed Properties
Molecular Weight:
446.591g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
7
Exact Mass:
446.257g/mol
Monoisotopic Mass:
446.257g/mol
Topological Polar Surface Area:
69.2A^2
Heavy Atom Count:
33
Formal Charge:
0
Complexity:
473
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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