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Home > Other Heterocycles > 64600-17-5
64600-17-5 | Methanone, (1-bicyclo[2.2.1]hept-2-yl-3-phenyl-2-aziridinyl)phenyl-
CAS No: 64600-17-5 Catalog No: AG006TDG MDL No:
Product Description
Catalog Number:
AG006TDG
Chemical Name:
Methanone, (1-bicyclo[2.2.1]hept-2-yl-3-phenyl-2-aziridinyl)phenyl-
CAS Number:
64600-17-5
Molecular Formula:
C22H23NO
Molecular Weight:
317.4241
IUPAC Name:
[1-(2-bicyclo[2.2.1]heptanyl)-3-phenylaziridin-2-yl]-phenylmethanone
InChI:
InChI=1S/C22H23NO/c24-22(17-9-5-2-6-10-17)21-20(16-7-3-1-4-8-16)23(21)19-14-15-11-12-18(19)13-15/h1-10,15,18-21H,11-14H2
InChI Key:
HAWYYZVGOUIBAZ-UHFFFAOYSA-N
SMILES:
O=C(C1N(C1c1ccccc1)C1CC2CC1CC2)c1ccccc1
Properties
Complexity:
476
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
317.178g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
317.432g/mol
Monoisotopic Mass:
317.178g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
20.1A^2
Undefined Atom Stereocenter Count:
5
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8
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