1-[(4-methoxyphenyl)methyl]azepan-2-one


Chemical Name: 1-[(4-methoxyphenyl)methyl]azepan-2-one
CAS Number: 1956354-75-8
Product Number: AG01DKI5(AG01DKI5)
Synonyms:
MDL No:
Molecular Formula: C14H19NO2
Molecular Weight: 233.3062

Identification/Properties


Computed Properties
Molecular Weight:
233.311g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
233.142g/mol
Monoisotopic Mass:
233.142g/mol
Topological Polar Surface Area:
29.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
247
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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