1-(4-methylphenyl)-3-(4-phenoxyanilino)-1-propanone


Chemical Name: 1-(4-methylphenyl)-3-(4-phenoxyanilino)-1-propanone
CAS Number: 477334-12-6
Product Number: AG00E6SU(AGN-PC-0WB0IM)
Synonyms:
MDL No: MFCD03934745
Molecular Formula: C22H21NO2
Molecular Weight: 331.4076

Identification/Properties


Computed Properties
Molecular Weight:
331.415g/mol
XLogP3:
5.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
7
Exact Mass:
331.157g/mol
Monoisotopic Mass:
331.157g/mol
Topological Polar Surface Area:
38.3A^2
Heavy Atom Count:
25
Formal Charge:
0
Complexity:
389
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:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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