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Home > Other Heterocycles > 5597-32-0
5597-32-0 | 2-azabicyclo[3.2.2]nonan-3-one
CAS No: 5597-32-0 Catalog No: AG01C36X MDL No:MFCD19217678
Product Description
Catalog Number:
AG01C36X
Chemical Name:
2-azabicyclo[3.2.2]nonan-3-one
CAS Number:
5597-32-0
Molecular Formula:
C8H13NO
Molecular Weight:
139.1949
MDL Number:
MFCD19217678
IUPAC Name:
2-azabicyclo[3.2.2]nonan-3-one
InChI:
InChI=1S/C8H13NO/c10-8-5-6-1-3-7(9-8)4-2-6/h6-7H,1-5H2,(H,9,10)
InChI Key:
USEQGBOOQRRTSE-UHFFFAOYSA-N
SMILES:
O=C1CC2CCC(N1)CC2
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
139.1g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
139.198g/mol
Monoisotopic Mass:
139.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
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