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Home > Other Heterocycles > 794533-98-5

794533-98-5

794533-98-5 | 5-phenyl-2-azabicyclo[2.2.1]heptane

CAS No: 794533-98-5 Catalog No: AG01C83G MDL No:MFCD20684638

Product Description

Catalog Number:
AG01C83G
Chemical Name:
5-phenyl-2-azabicyclo[2.2.1]heptane
CAS Number:
794533-98-5
Molecular Formula:
C12H15N
Molecular Weight:
173.2542
MDL Number:
MFCD20684638
IUPAC Name:
5-phenyl-2-azabicyclo[2.2.1]heptane
InChI:
InChI=1S/C12H15N/c1-2-4-9(5-3-1)12-7-11-6-10(12)8-13-11/h1-5,10-13H,6-8H2
InChI Key:
MUROLIFHOWBXIX-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C1CC2CC1CN2

Properties

Complexity:
184  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.12g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.259g/mol
Monoisotopic Mass:
173.12g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
3  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  

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