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Home > Other Heterocycles > 88721-87-3
88721-87-3 | 1-Azabicyclo[4.3.1]decane-8-carbonitrile
CAS No: 88721-87-3 Catalog No: AG0046LN MDL No:
Product Description
Catalog Number:
AG0046LN
Chemical Name:
1-Azabicyclo[4.3.1]decane-8-carbonitrile
CAS Number:
88721-87-3
Molecular Formula:
C10H16N2
Molecular Weight:
164.2474
IUPAC Name:
1-azabicyclo[4.3.1]decane-8-carbonitrile
InChI:
InChI=1S/C10H16N2/c11-6-10-5-9-3-1-2-4-12(7-9)8-10/h9-10H,1-5,7-8H2
InChI Key:
ZKEOKLGLIBQAJC-UHFFFAOYSA-N
SMILES:
N#CC1CC2CCCCN(C1)C2
Properties
Complexity:
203
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:
0
Topological Polar Surface Area:
27A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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