tert-butyl (1R,6S)-2,5-diazabicyclo[4.2.0]octane-2-carboxylate

tert-butyl (1R,6S)-2,5-diazabicyclo[4.2.0]octane-2-carboxylate

CAS: 2514607-31-7

Formula: C11H20N2O2

SMILES: CC(C)(C)OC(=O)N1CCN[C@H]2CC[C@@H]12

IUPAC: tert-butyl (1R,6S)-2,5-diazabicyclo[4.2.0]octane-2-carboxylate

InChI: InChI=1S/C11H20N2O2/c1-11(2,3)15-10(14)13-7-6-12-8-4-5-9(8)13/h8-9,12H,4-7H2,1-3H3/t8-,9+/m0/s1

Composition: C (62.24%), H (9.50%), N (13.20%), O (15.07%)

Molar Mass: 212.293

Atom Count: 35

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	212.152477892
Formal Charge	0
FSP3	0.91
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	JIIFXMDXOJFVMW-DTWKUNHWSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.33
Topological Polar Surface Area	41.57
Polarizability	22.97
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2514607-31-7		$268.59-$1,104.64$268.59$428.74$737.69$1,104.64