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

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

CAS: 864684-96-8

Formula: C12H21NO3

SMILES: CC(C)(C)OC(=O)N1CCC2(CCO2)CC1

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

InChI: InChI=1S/C12H21NO3/c1-11(2,3)16-10(14)13-7-4-12(5-8-13)6-9-15-12/h4-9H2,1-3H3

Composition: C (63.41%), H (9.31%), N (6.16%), O (21.12%)

Molar Mass: 227.304

Atom Count: 37

Heavy Atom Count: 16

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 0
Exact Mass 227.15214354
Formal Charge 0
FSP3 0.92
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 0
InChIKey WTKKPVRQCZKUDT-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 60.95
Topological Polar Surface Area 38.77
Polarizability 23.99
Ring Count 2
Rotatable Bond Count 2

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97% <7 Days 864684-96-8 $23.81-$1,137.47$23.81$26.91$67.28$246.33$489.56$1,137.47
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95% 1 Day 864684-96-8 $36.29-$1,595.77$36.29$90.49$180.98$452.47$797.88$1,595.77
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