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Home > Other Heterocycles > 860265-67-4
860265-67-4 | N-BOC-2-AZABICYCLO[2.2.1]HEPTAN-7-ONE
CAS No: 860265-67-4 Catalog No: AG00GSIA MDL No:
Product Description
Catalog Number:
AG00GSIA
Chemical Name:
N-BOC-2-AZABICYCLO[2.2.1]HEPTAN-7-ONE
CAS Number:
860265-67-4
Molecular Formula:
C11H17NO3
Molecular Weight:
211.2576
IUPAC Name:
tert-butyl 7-oxo-2-azabicyclo[2.2.1]heptane-2-carboxylate
InChI:
InChI=1S/C11H17NO3/c1-11(2,3)15-10(14)12-6-7-4-5-8(12)9(7)13/h7-8H,4-6H2,1-3H3
InChI Key:
CGBZZSVXPMUYMV-UHFFFAOYSA-N
SMILES:
O=C(N1CC2C(=O)C1CC2)OC(C)(C)C
Properties
Complexity:
305
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.121g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
211.261g/mol
Monoisotopic Mass:
211.121g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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