tert-butyl 7-oxo-3,6-diazabicyclo[3.2.2]nonane-3-carboxylate

tert-butyl 7-oxo-3,6-diazabicyclo[3.2.2]nonane-3-carboxylate

CAS: 1784807-21-1

Formula: C12H20N2O3

SMILES: CC(C)(C)OC(=O)N1CC2CCC(C1)C(=O)N2

IUPAC: tert-butyl 7-oxo-3,6-diazabicyclo[3.2.2]nonane-3-carboxylate

InChI: InChI=1/C12H20N2O3/c1-12(2,3)17-11(16)14-6-8-4-5-9(7-14)13-10(8)15/h8-9H,4-7H2,1-3H3,(H,13,15)

Composition: C (59.98%), H (8.39%), N (11.66%), O (19.97%)

Molar Mass: 240.303

Atom Count: 37

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	240.147392512
Formal Charge	0
FSP3	0.83
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PDTLUVMGYJWBHZ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	62.34
Topological Polar Surface Area	58.64
Polarizability	24.53
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	1784807-21-1		$292.55-$3,605.20$292.55$466.57$802.00$1,201.73$3,605.20