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tert-butyl 1-azaspiro[3.5]nonane-7-carboxylate

tert-butyl 1-azaspiro[3.5]nonane-7-carboxylate

CAS: 2384024-73-9

Formula: C13H23NO2

SMILES: CC(C)(C)OC(=O)C1CCC2(CCN2)CC1

IUPAC: tert-butyl 1-azaspiro[3.5]nonane-7-carboxylate

InChI: InChI=1S/C13H23NO2/c1-12(2,3)16-11(15)10-4-6-13(7-5-10)8-9-14-13/h10,14H,4-9H2,1-3H3

Composition: C (69.29%), H (10.29%), N (6.22%), O (14.20%)

Molar Mass: 225.332

Atom Count: 39

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 225.172878985
Formal Charge 0
FSP3 0.92
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey GWIVTHBWGNIQBZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 63.31
Topological Polar Surface Area 38.33
Polarizability 25.51
Ring Count 2
Rotatable Bond Count 3

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