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tert-butyl 2,5-diazaspiro[3.5]nonane-5-carboxylate

tert-butyl 2,5-diazaspiro[3.5]nonane-5-carboxylate

CAS: 1246035-53-9

Formula: C12H22N2O2

SMILES: CC(C)(C)OC(=O)N1CCCCC11CNC1

IUPAC: tert-butyl 2,5-diazaspiro[3.5]nonane-5-carboxylate

InChI: InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-7-5-4-6-12(14)8-13-9-12/h13H,4-9H2,1-3H3

Composition: C (63.69%), H (9.80%), N (12.38%), O (14.14%)

Molar Mass: 226.32

Atom Count: 38

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 226.168127956
Formal Charge 0
FSP3 0.92
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 1
InChIKey MYPWDUFYPPMTKQ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 62.15
Topological Polar Surface Area 41.57
Polarizability 24.81
Ring Count 2
Rotatable Bond Count 2

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