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tert-butyl 8-oxo-2,6,9-triazaspiro[4.5]decane-2-carboxylate

tert-butyl 8-oxo-2,6,9-triazaspiro[4.5]decane-2-carboxylate

CAS: 1160247-09-5

Formula: C12H21N3O3

SMILES: CC(C)(C)OC(=O)N1CCC2(C1)CNC(=O)CN2

IUPAC: tert-butyl 8-oxo-2,6,9-triazaspiro[4.5]decane-2-carboxylate

InChI: InChI=1/C12H21N3O3/c1-11(2,3)18-10(17)15-5-4-12(8-15)7-13-9(16)6-14-12/h14H,4-8H2,1-3H3,(H,13,16)

Composition: C (56.45%), H (8.29%), N (16.46%), O (18.80%)

Molar Mass: 255.318

Atom Count: 39

Heavy Atom Count: 18

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 1
Exact Mass 255.158291548
Formal Charge 0
FSP3 0.83
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 3
Hydrogen Bond Donor Count 2
InChIKey ROMVOPIIRBONLN-UHFFFAOYNA-N
Lipinski's Rule of Five 1
Molar Refractivity 65.7
Topological Polar Surface Area 70.67
Polarizability 26.06
Ring Count 2
Rotatable Bond Count 2

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Purity LeadTime CAS PacketSize UnitPrice
97% <5 Days 1160247-09-5 $97.10-$322.82$97.10$192.93$322.82
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