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Home > Other Heterocycles > 146747-65-1
146747-65-1 | N-Cbz-9-Azabicyclo[3.3.1]nonan-3-one
CAS No: 146747-65-1 Catalog No: AG003SW3 MDL No:MFCD22371802
Product Description
Catalog Number:
AG003SW3
Chemical Name:
N-Cbz-9-Azabicyclo[3.3.1]nonan-3-one
CAS Number:
146747-65-1
Molecular Formula:
C16H19NO3
Molecular Weight:
273.3270
MDL Number:
MFCD22371802
IUPAC Name:
benzyl 3-oxo-9-azabicyclo[3.3.1]nonane-9-carboxylate
InChI:
InChI=1S/C16H19NO3/c18-15-9-13-7-4-8-14(10-15)17(13)16(19)20-11-12-5-2-1-3-6-12/h1-3,5-6,13-14H,4,7-11H2
InChI Key:
PECCPMURUGQWAT-UHFFFAOYSA-N
SMILES:
O=C1CC2CCCC(C1)N2C(=O)OCc1ccccc1
Properties
Complexity:
360
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
273.136g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
273.332g/mol
Monoisotopic Mass:
273.136g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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