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tert-butyl 2-oxo-7-azabicyclo[2.2.1]heptane-7-carboxylate

tert-butyl 2-oxo-7-azabicyclo[2.2.1]heptane-7-carboxylate

CAS: 152533-47-6

Formula: C11H17NO3

SMILES: CC(C)(C)OC(=O)N1C2CCC1C(=O)C2

IUPAC: tert-butyl 2-oxo-7-azabicyclo[2.2.1]heptane-7-carboxylate

InChI: InChI=1/C11H17NO3/c1-11(2,3)15-10(14)12-7-4-5-8(12)9(13)6-7/h7-8H,4-6H2,1-3H3

Composition: C (62.54%), H (8.11%), N (6.63%), O (22.72%)

Molar Mass: 211.261

Atom Count: 32

Heavy Atom Count: 15

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 211.120843411
Formal Charge 0
FSP3 0.82
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey XWIJVOQGKJHEAJ-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 54.42
Topological Polar Surface Area 46.61
Polarizability 21.55
Ring Count 2
Rotatable Bond Count 2

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