tert-butyl 9,9-difluoro-1-oxo-2,7-diazaspiro[4.5]decane-7-carboxylate

tert-butyl 9,9-difluoro-1-oxo-2,7-diazaspiro[4.5]decane-7-carboxylate

CAS: 1373502-80-7

Formula: C13H20F2N2O3

SMILES: CC(C)(C)OC(=O)N1CC2(CCNC2=O)CC(F)(F)C1

IUPAC: tert-butyl 9,9-difluoro-1-oxo-2,7-diazaspiro[4.5]decane-7-carboxylate

InChI: InChI=1/C13H20F2N2O3/c1-11(2,3)20-10(19)17-7-12(4-5-16-9(12)18)6-13(14,15)8-17/h4-8H2,1-3H3,(H,16,18)

Composition: C (53.78%), H (6.94%), F (13.09%), N (9.65%), O (16.53%)

Molar Mass: 290.311

Atom Count: 40

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	290.144198838
Formal Charge	0
FSP3	0.85
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NBGABIOSBPKNEQ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	67.58
Topological Polar Surface Area	58.64
Polarizability	25.98
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<5 Days	1373502-80-7		$650.68-$3,060.45$650.68$1,252.17$3,060.45