Home Nitriles 1,5-diazabicyclo[3.2.2]nonane-6-carbonitrile

1,5-diazabicyclo[3.2.2]nonane-6-carbonitrile

CAS No.:
1803593-19-2
Catalog Number:
AG01B1AU
Molecular Formula:
C8H13N3
Molecular Weight:
151.2089
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Product Description
Catalog Number:
AG01B1AU
Chemical Name:
1,5-diazabicyclo[3.2.2]nonane-6-carbonitrile
CAS Number:
1803593-19-2
Molecular Formula:
C8H13N3
Molecular Weight:
151.2089
MDL Number:
MFCD28246213
IUPAC Name:
1,5-diazabicyclo[3.2.2]nonane-6-carbonitrile
InChI:
InChI=1S/C8H13N3/c9-6-8-7-10-2-1-3-11(8)5-4-10/h8H,1-5,7H2
InChI Key:
AUVZEJYYMHQPER-UHFFFAOYSA-N
SMILES:
N#CC1CN2CCCN1CC2
Properties
Complexity:
193  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.111g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
151.213g/mol
Monoisotopic Mass:
151.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties