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Home > Other Heterocycles > 93865-26-0

93865-26-0

93865-26-0 | "3-Benzyl-3,9-diaza-bicyclo[3.3.1]nonane dihydrochloride"

CAS No: 93865-26-0 Catalog No: AG01FPB5 MDL No:MFCD22587936

Product Description

Catalog Number:
AG01FPB5
Chemical Name:
"3-Benzyl-3,9-diaza-bicyclo[3.3.1]nonane dihydrochloride"
CAS Number:
93865-26-0
Molecular Formula:
C14H22Cl2N2
Molecular Weight:
289.2439
MDL Number:
MFCD22587936
IUPAC Name:
3-benzyl-3,9-diazabicyclo[3.3.1]nonane;dihydrochloride
InChI:
InChI=1S/C14H20N2.2ClH/c1-2-5-12(6-3-1)9-16-10-13-7-4-8-14(11-16)15-13;;/h1-3,5-6,13-15H,4,7-11H2;2*1H
InChI Key:
HOHUHMWMFGXUNW-UHFFFAOYSA-N
SMILES:
C1CC2NC(C1)CN(C2)Cc1ccccc1.Cl.Cl

Properties

Complexity:
211  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.116g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
289.244g/mol
Monoisotopic Mass:
288.116g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0

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