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Home > Other Heterocycles > 1187161-00-7
1187161-00-7 | 9-cyclopropyl-9-azabicyclo[3.3.1]nonan-3-one
CAS No: 1187161-00-7 Catalog No: AG019R41 MDL No:MFCD13196353
Product Description
Catalog Number:
AG019R41
Chemical Name:
9-cyclopropyl-9-azabicyclo[3.3.1]nonan-3-one
CAS Number:
1187161-00-7
Molecular Formula:
C11H17NO
Molecular Weight:
179.2588
MDL Number:
MFCD13196353
IUPAC Name:
9-cyclopropyl-9-azabicyclo[3.3.1]nonan-3-one
InChI:
InChI=1S/C11H17NO/c13-11-6-9-2-1-3-10(7-11)12(9)8-4-5-8/h8-10H,1-7H2
InChI Key:
YBAFNVQVRAGMGF-UHFFFAOYSA-N
SMILES:
O=C1CC2CCCC(C1)N2C1CC1
Properties
Complexity:
218
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.263g/mol
Monoisotopic Mass:
179.131g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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