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Home > Other Heterocycles > 35193-93-2
35193-93-2 | 8-phenyl-8-azabicyclo[3.2.1]octan-3-one
CAS No: 35193-93-2 Catalog No: AG01A3M7 MDL No:MFCD01463740
Product Description
Catalog Number:
AG01A3M7
Chemical Name:
8-phenyl-8-azabicyclo[3.2.1]octan-3-one
CAS Number:
35193-93-2
Molecular Formula:
C13H15NO
Molecular Weight:
201.2643
MDL Number:
MFCD01463740
IUPAC Name:
8-phenyl-8-azabicyclo[3.2.1]octan-3-one
InChI:
InChI=1S/C13H15NO/c15-13-8-11-6-7-12(9-13)14(11)10-4-2-1-3-5-10/h1-5,11-12H,6-9H2
InChI Key:
PCEVDKVFKSUXFX-UHFFFAOYSA-N
SMILES:
O=C1CC2CCC(C1)N2c1ccccc1
NSC Number:
167858
Properties
Complexity:
241
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.115g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.269g/mol
Monoisotopic Mass:
201.115g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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