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Home > Other Heterocycles > 84904-97-2
84904-97-2 | 1,7-DIAZABICYCLO[5.3.2]DODECANE
CAS No: 84904-97-2 Catalog No: AG004PUU MDL No:
Product Description
Catalog Number:
AG004PUU
Chemical Name:
1,7-DIAZABICYCLO[5.3.2]DODECANE
CAS Number:
84904-97-2
Molecular Formula:
C10H20N2
Molecular Weight:
168.2792
IUPAC Name:
1,7-diazabicyclo[5.3.2]dodecane
InChI:
InChI=1S/C10H20N2/c1-2-5-11-7-4-8-12(6-3-1)10-9-11/h1-10H2
InChI Key:
QVDQQPFABXMASK-UHFFFAOYSA-N
SMILES:
C1CCN2CCCN(CC1)CC2
Properties
Complexity:
122
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.163g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.284g/mol
Monoisotopic Mass:
168.163g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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