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Home > Other Heterocycles > 1199-73-1
1199-73-1 | 3-Azabicyclo[3.2.2]nonane-3-acetonitrile
CAS No: 1199-73-1 Catalog No: AG000PUM MDL No:
Product Description
Catalog Number:
AG000PUM
Chemical Name:
3-Azabicyclo[3.2.2]nonane-3-acetonitrile
CAS Number:
1199-73-1
Molecular Formula:
C10H16N2
Molecular Weight:
164.2474
IUPAC Name:
2-(3-azabicyclo[3.2.2]nonan-3-yl)acetonitrile
InChI:
InChI=1S/C10H16N2/c11-5-6-12-7-9-1-2-10(8-12)4-3-9/h9-10H,1-4,6-8H2
InChI Key:
FQSHZFMVVXODNQ-UHFFFAOYSA-N
SMILES:
N#CCN1CC2CCC(C1)CC2
Properties
Complexity:
181
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.131g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.252g/mol
Monoisotopic Mass:
164.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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