Home Carboxys Benzyl 6-oxo-3-azabicyclo[3.1.1]heptane-3-carboxylate

Benzyl 6-oxo-3-azabicyclo[3.1.1]heptane-3-carboxylate

CAS No.:
1434142-13-8
Catalog Number:
AG00HWX6
Molecular Formula:
C14H15NO3
Molecular Weight:
245.2738
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG00HWX6
Chemical Name:
Benzyl 6-oxo-3-azabicyclo[3.1.1]heptane-3-carboxylate
CAS Number:
1434142-13-8
Molecular Formula:
C14H15NO3
Molecular Weight:
245.2738
IUPAC Name:
benzyl 6-oxo-3-azabicyclo[3.1.1]heptane-3-carboxylate
InChI:
InChI=1S/C14H15NO3/c16-13-11-6-12(13)8-15(7-11)14(17)18-9-10-4-2-1-3-5-10/h1-5,11-12H,6-9H2
InChI Key:
TYGFNYVBAIHYBE-UHFFFAOYSA-N
SMILES:
O=C(N1CC2CC(C1)C2=O)OCc1ccccc1
Properties
Complexity:
335  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.105g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.278g/mol
Monoisotopic Mass:
245.105g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties