tert-butyl 2-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate

tert-butyl 2-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate

CAS: 1823261-31-9

Formula: C13H24N2O2

SMILES: CC(C)(C)OC(=O)N1C2CCCC1C(N)CC2

IUPAC: tert-butyl 2-amino-9-azabicyclo[3.3.1]nonane-9-carboxylate

InChI: InChI=1/C13H24N2O2/c1-13(2,3)17-12(16)15-9-5-4-6-11(15)10(14)8-7-9/h9-11H,4-8,14H2,1-3H3

Composition: C (64.97%), H (10.07%), N (11.66%), O (13.31%)

Molar Mass: 240.347

Atom Count: 41

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	240.183778021
Formal Charge	0
FSP3	0.92
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	PKSZGPBBVMWUDH-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	66.33
Topological Polar Surface Area	55.56
Polarizability	26.65
Ring Count	2
Rotatable Bond Count	2

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97%	<5 Days	1823261-31-9		$244.63-$2,938.13$244.63$389.65$640.59$1,046.63$2,938.13