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Home > Other Heterocycles > 189243-26-3
189243-26-3 | 2-Propanone, 1-(1-azabicyclo[2.2.2]oct-3-ylidene)-, (1E)-
CAS No: 189243-26-3 Catalog No: AG002I4E MDL No:
Product Description
Catalog Number:
AG002I4E
Chemical Name:
2-Propanone, 1-(1-azabicyclo[2.2.2]oct-3-ylidene)-, (1E)-
CAS Number:
189243-26-3
Molecular Formula:
C10H15NO
Molecular Weight:
165.2322
IUPAC Name:
1-(1-azabicyclo[2.2.2]octan-3-ylidene)propan-2-one
InChI:
InChI=1S/C10H15NO/c1-8(12)6-10-7-11-4-2-9(10)3-5-11/h6,9H,2-5,7H2,1H3
InChI Key:
XVFBZAKFUWQJMY-UHFFFAOYSA-N
SMILES:
CC(=O)/C=C\1/CN2CCC1CC2
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.115g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
165.236g/mol
Monoisotopic Mass:
165.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
0.2
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