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9-(tert-butoxycarbonyl)-2-oxa-9-azaspiro[5.5]undecane-3-carboxylic acid

9-(tert-butoxycarbonyl)-2-oxa-9-azaspiro[5.5]undecane-3-carboxylic acid

CAS: 1160246-98-9

Formula: C15H25NO5

SMILES: CC(C)(C)OC(=O)N1CCC2(CCC(OC2)C(O)=O)CC1

IUPAC: 9-[(tert-butoxy)carbonyl]-2-oxa-9-azaspiro[5.5]undecane-3-carboxylic acid

InChI: InChI=1/C15H25NO5/c1-14(2,3)21-13(19)16-8-6-15(7-9-16)5-4-11(12(17)18)20-10-15/h11H,4-10H2,1-3H3,(H,17,18)

Composition: C (60.18%), H (8.42%), N (4.68%), O (26.72%)

Molar Mass: 299.367

Atom Count: 46

Heavy Atom Count: 21

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 299.173272909
Formal Charge 0
FSP3 0.87
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey ITMBUXNOUOBFFK-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 76.08
Topological Polar Surface Area 76.07
Polarizability 30.09
Ring Count 2
Rotatable Bond Count 3

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97% <5 Days 1160246-98-9 $403.52-$649.42$403.52$649.42
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