(1R,2S,9S)-7,11-diazatricyclo[7.3.1.0²,?]tridecane dihydrochloride

(1R,2S,9S)-7,11-diazatricyclo[7.3.1.0²,?]tridecane dihydrochloride

CAS: 2121-08-6

Formula: C11H22Cl2N2

SMILES: Cl.Cl.C1CCN2C[C@@H]3CNC[C@@H](C3)[C@@H]2C1

IUPAC: (1R,2S,9S)-7,11-diazatricyclo[7.3.1.0²,?]tridecane dihydrochloride

InChI: InChI=1S/C11H20N2.2ClH/c1-2-4-13-8-9-5-10(7-12-6-9)11(13)3-1;;/h9-12H,1-8H2;2*1H/t9-,10+,11-;;/m0../s1

Composition: C (52.18%), H (8.76%), Cl (28.00%), N (11.06%)

Molar Mass: 253.21

Atom Count: 37

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	3
Exact Mass	252.1160041
Formal Charge	0
FSP3	1
Hetero Ring Count	3
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	NTGJEGQLBWHVQV-VJRYUMJJSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.72
Topological Polar Surface Area	15.27
Polarizability	21.87
Ring Count	3
Rotatable Bond Count	0

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Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<4 Days	2121-08-6		$215.05-$936.10$215.05$936.10