Home Halogens (1R,4R,7R)-7-bromo-2-((S)-1-phenylethyl)-2-azabicyclo[2.2.1]heptane

(1R,4R,7R)-7-bromo-2-((S)-1-phenylethyl)-2-azabicyclo[2.2.1]heptane

CAS No.:
881844-56-0
Catalog Number:
AG01DIQR
Molecular Formula:
C14H18BrN
Molecular Weight:
280.2034
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Product Description
Catalog Number:
AG01DIQR
Chemical Name:
(1R,4R,7R)-7-bromo-2-((S)-1-phenylethyl)-2-azabicyclo[2.2.1]heptane
CAS Number:
881844-56-0
Molecular Formula:
C14H18BrN
Molecular Weight:
280.2034
MDL Number:
MFCD31652846
IUPAC Name:
(1R,4R,7R)-7-bromo-2-[(1S)-1-phenylethyl]-2-azabicyclo[2.2.1]heptane
InChI:
InChI=1S/C14H18BrN/c1-10(11-5-3-2-4-6-11)16-9-12-7-8-13(16)14(12)15/h2-6,10,12-14H,7-9H2,1H3/t10-,12+,13+,14+/m0/s1
InChI Key:
GLGPDOYNZDNHCK-IGHBBLSQSA-N
SMILES:
Br[C@@H]1[C@@H]2CC[C@H]1N(C2)[C@H](c1ccccc1)C
Properties
Complexity:
249  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
4  
Defined Bond Stereocenter Count:
0
Exact Mass:
279.062g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.209g/mol
Monoisotopic Mass:
279.062g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
Properties