6-Azabicyclo[3.2.0]heptan-7-one, (1S,5R)-


Chemical Name: 6-Azabicyclo[3.2.0]heptan-7-one, (1S,5R)-
CAS Number: 39155-95-8
Product Number: AG00765X(AGN-PC-0O9SB6)
Synonyms:
MDL No:
Molecular Formula: C6H9NO
Molecular Weight: 111.1418

Identification/Properties


Computed Properties
Molecular Weight:
111.144g/mol
XLogP3:
0.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
111.068g/mol
Monoisotopic Mass:
111.068g/mol
Topological Polar Surface Area:
29.1A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
133
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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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