tert-butyl (1R,5R)-3,6-diazabicyclo[3.2.0]heptane-3-carboxylate hydrochloride

tert-butyl (1R,5R)-3,6-diazabicyclo[3.2.0]heptane-3-carboxylate hydrochloride

CAS: 2306246-64-8

Formula: C10H19ClN2O2

SMILES: Cl.CC(C)(C)OC(=O)N1C[C@H]2CN[C@H]2C1

IUPAC: tert-butyl (1R,5R)-3,6-diazabicyclo[3.2.0]heptane-3-carboxylate hydrochloride

InChI: InChI=1S/C10H18N2O2.ClH/c1-10(2,3)14-9(13)12-5-7-4-11-8(7)6-12;/h7-8,11H,4-6H2,1-3H3;1H/t7-,8+;/m1./s1

Composition: C (51.17%), H (8.16%), Cl (15.10%), N (11.93%), O (13.63%)

Molar Mass: 234.72

Atom Count: 34

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	2
Exact Mass	234.1135056
Formal Charge	0
FSP3	0.9
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	CTVDRVRVOABUPB-WLYNEOFISA-N
Lipinski's Rule of Five	1
Molar Refractivity	52.7
Topological Polar Surface Area	41.57
Polarizability	21.13
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2306246-64-8		$199.24-$2,455.17$199.24$317.77$546.01$818.39$2,455.17