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Home > Other Heterocycles > 1384788-48-0
1384788-48-0 | 6-phenyl-7-azabicyclo[4.2.0]octane
CAS No: 1384788-48-0 Catalog No: AG019ZP2 MDL No:MFCD22375286
Product Description
Catalog Number:
AG019ZP2
Chemical Name:
6-phenyl-7-azabicyclo[4.2.0]octane
CAS Number:
1384788-48-0
Molecular Formula:
C13H17N
Molecular Weight:
187.2808
MDL Number:
MFCD22375286
IUPAC Name:
6-phenyl-7-azabicyclo[4.2.0]octane
InChI:
InChI=1S/C13H17N/c1-2-6-11(7-3-1)13-9-5-4-8-12(13)10-14-13/h1-3,6-7,12,14H,4-5,8-10H2
InChI Key:
GDORPEUJQLHRFJ-UHFFFAOYSA-N
SMILES:
C1CCC2(C(C1)CN2)c1ccccc1
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.136g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.286g/mol
Monoisotopic Mass:
187.136g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
12A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6
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