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(1R,4R)-2,5-diazabicyclo[2.2.2]octane

(1R,4R)-2,5-diazabicyclo[2.2.2]octane

CAS: 1187931-60-7

Formula: C6H12N2

SMILES: C1C[C@@H]2CN[C@H]1CN2

IUPAC: (1R,4R)-2,5-diazabicyclo[2.2.2]octane

InChI: InChI=1S/C6H12N2/c1-2-6-4-7-5(1)3-8-6/h5-8H,1-4H2/t5-,6-/m1/s1

Composition: C (64.24%), H (10.78%), N (24.97%)

Molar Mass: 112.176

Atom Count: 20

Heavy Atom Count: 8

Properties
Properties
Common Names N/A
Aromatic Ring Count 0
Asymmetric Atom Count 2
Exact Mass 112.100048394
Formal Charge 0
FSP3 1
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 2
Hydrogen Bond Donor Count 2
InChIKey DJWDAKFSDBOQJK-PHDIDXHHSA-N
Lipinski's Rule of Five 1
Molar Refractivity 32.33
Topological Polar Surface Area 24.06
Polarizability 13.38
Ring Count 2
Rotatable Bond Count 0

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97% <2 Days 1187931-60-7 $11,270.00-$3,312.00$2,162.00$3,312.00$11,270.00
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