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Home > Other Heterocycles > 833458-92-7
833458-92-7 | 3-Azabicyclo[3.2.1]octan-6-one, 3-(phenylmethyl)-
CAS No: 833458-92-7 Catalog No: AG004W8S MDL No:
Product Description
Catalog Number:
AG004W8S
Chemical Name:
3-Azabicyclo[3.2.1]octan-6-one, 3-(phenylmethyl)-
CAS Number:
833458-92-7
Molecular Formula:
C14H17NO
Molecular Weight:
215.2909
IUPAC Name:
3-benzyl-3-azabicyclo[3.2.1]octan-6-one
InChI:
InChI=1S/C14H17NO/c16-14-7-12-6-13(14)10-15(9-12)8-11-4-2-1-3-5-11/h1-5,12-13H,6-10H2
InChI Key:
YMWCPRJSIYTHOZ-UHFFFAOYSA-N
SMILES:
O=C1CC2CC1CN(C2)Cc1ccccc1
Properties
Complexity:
270
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
215.131g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
215.296g/mol
Monoisotopic Mass:
215.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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