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Home > Other Heterocycles > 89003-09-8
89003-09-8 | 1-Azabicyclo[3.3.1]nonan-2-one, 5,7,7-trimethyl-
CAS No: 89003-09-8 Catalog No: AG0045L8 MDL No:
Product Description
Catalog Number:
AG0045L8
Chemical Name:
1-Azabicyclo[3.3.1]nonan-2-one, 5,7,7-trimethyl-
CAS Number:
89003-09-8
Molecular Formula:
C11H19NO
Molecular Weight:
181.2747
IUPAC Name:
5,7,7-trimethyl-1-azabicyclo[3.3.1]nonan-2-one
InChI:
InChI=1S/C11H19NO/c1-10(2)6-11(3)5-4-9(13)12(7-10)8-11/h4-8H2,1-3H3
InChI Key:
YCITZKBYHURYKB-UHFFFAOYSA-N
SMILES:
O=C1CCC2(CN1CC(C2)(C)C)C
Properties
Complexity:
247
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.147g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
181.279g/mol
Monoisotopic Mass:
181.147g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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