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Home > Other Heterocycles > 86215-93-2
86215-93-2 | 3-Azabicyclo[3.1.0]hexane, 1-[4-(phenylmethyl)phenyl]-
CAS No: 86215-93-2 Catalog No: AG004NH3 MDL No:
Product Description
Catalog Number:
AG004NH3
Chemical Name:
3-Azabicyclo[3.1.0]hexane, 1-[4-(phenylmethyl)phenyl]-
CAS Number:
86215-93-2
Molecular Formula:
C18H19N
Molecular Weight:
249.3502
IUPAC Name:
1-(4-benzylphenyl)-3-azabicyclo[3.1.0]hexane
InChI:
InChI=1S/C18H19N/c1-2-4-14(5-3-1)10-15-6-8-16(9-7-15)18-11-17(18)12-19-13-18/h1-9,17,19H,10-13H2
InChI Key:
GLOMMWPIVNLVLJ-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)Cc1ccc(cc1)C12CNCC2C1
Properties
Complexity:
312
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.152g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
249.357g/mol
Monoisotopic Mass:
249.152g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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